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Database: PDB
Entry: 6U09
LinkDB: 6U09
Original site: 6U09 
HEADER    TRANSLATION/INHIBITOR                   13-AUG-19   6U09              
TITLE     DISCOVERY OF LYSINE-TARGETED EIF4E INHIBITORS THROUGH COVALENT DOCKING
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: EUKARYOTIC TRANSLATION INITIATION FACTOR 4E;               
COMPND   3 CHAIN: A, B, C, D;                                                   
COMPND   4 SYNONYM: MRNA CAP-BINDING PROTEIN,EIF-4F 25 KDA SUBUNIT;             
COMPND   5 ENGINEERED: YES;                                                     
COMPND   6 OTHER_DETAILS: COVALENT LYSINE INHIBITOR                             
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
SOURCE   4 ORGANISM_TAXID: 10090;                                               
SOURCE   5 GENE: EIF4E;                                                         
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
KEYWDS    CAP-BINDING SITE, ANTI-NEOPLASTIC, INHIBITOR, TRANSLATION INITIATION  
KEYWDS   2 BLOCKING, TRANSLATION-INHIBITOR COMPLEX                              
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    X.B.WAN,B.K.SHOICHET,J.TAUNTON                                        
REVDAT   1   23-OCT-19 6U09    0                                                
JRNL        AUTH   X.B.WAN,B.K.SHOICHET,J.TAUNTON                               
JRNL        TITL   DISCOVERY OF NOVEL COVALENT EIF4E LYSINE INHIBITORS THROUGH  
JRNL        TITL 2 COVALENT DOCKING                                             
JRNL        REF    TO BE PUBLISHED                                              
JRNL        REFN                                                                
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.79 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX PHENIX-1.13-2998                              
REMARK   3   AUTHORS     : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN            
REMARK   3               : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE,           
REMARK   3               : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER,            
REMARK   3               : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY,              
REMARK   3               : REETAL PAI,RANDY READ,JANE RICHARDSON,               
REMARK   3               : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI,           
REMARK   3               : NICHOLAS SAUTER,JACOB SMITH,LAURENT                  
REMARK   3               : STORONI,TOM TERWILLIGER,PETER ZWART                  
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : ML                                            
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 1.79                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 73.53                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.970                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 93.7                           
REMARK   3   NUMBER OF REFLECTIONS             : 71772                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.193                           
REMARK   3   R VALUE            (WORKING SET) : 0.191                           
REMARK   3   FREE R VALUE                     : 0.238                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 4.830                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 3466                            
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT (IN BINS).                           
REMARK   3   BIN  RESOLUTION RANGE  COMPL.    NWORK NFREE   RWORK  RFREE        
REMARK   3     1 73.5250 -  5.2335    0.97     2839   149  0.1812 0.2271        
REMARK   3     2  5.2335 -  4.1541    0.96     2773   141  0.1592 0.1940        
REMARK   3     3  4.1541 -  3.6290    0.96     2805   156  0.1592 0.2121        
REMARK   3     4  3.6290 -  3.2972    0.95     2774   128  0.1734 0.2097        
REMARK   3     5  3.2972 -  3.0608    0.95     2790   137  0.1807 0.2286        
REMARK   3     6  3.0608 -  2.8804    0.95     2758   118  0.1828 0.2509        
REMARK   3     7  2.8804 -  2.7361    0.95     2772   117  0.1954 0.2488        
REMARK   3     8  2.7361 -  2.6170    0.95     2788   165  0.1895 0.2483        
REMARK   3     9  2.6170 -  2.5163    0.95     2721   139  0.1948 0.2775        
REMARK   3    10  2.5163 -  2.4294    0.94     2730   172  0.1982 0.2577        
REMARK   3    11  2.4294 -  2.3535    0.95     2748   152  0.1925 0.2365        
REMARK   3    12  2.3535 -  2.2862    0.94     2697   145  0.1945 0.2442        
REMARK   3    13  2.2862 -  2.2260    0.94     2740   131  0.1978 0.2302        
REMARK   3    14  2.2260 -  2.1717    0.94     2778   130  0.2100 0.2620        
REMARK   3    15  2.1717 -  2.1223    0.93     2637   149  0.2091 0.2570        
REMARK   3    16  2.1223 -  2.0771    0.94     2854   110  0.2160 0.2514        
REMARK   3    17  2.0771 -  2.0356    0.92     2691   114  0.2170 0.2531        
REMARK   3    18  2.0356 -  1.9972    0.93     2623   161  0.2307 0.3073        
REMARK   3    19  1.9972 -  1.9615    0.93     2769   151  0.2407 0.2563        
REMARK   3    20  1.9615 -  1.9282    0.92     2625   143  0.2561 0.3027        
REMARK   3    21  1.9282 -  1.8971    0.92     2651   140  0.2758 0.2826        
REMARK   3    22  1.8971 -  1.8680    0.92     2760   131  0.2784 0.3316        
REMARK   3    23  1.8680 -  1.8405    0.91     2619   144  0.3036 0.3419        
REMARK   3    24  1.8405 -  1.8146    0.91     2625   112  0.3149 0.3592        
REMARK   3    25  1.8146 -  1.7900    0.91     2739   131  0.3269 0.3870        
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED        : FLAT BULK SOLVENT MODEL                       
REMARK   3   SOLVENT RADIUS     : 1.11                                          
REMARK   3   SHRINKAGE RADIUS   : 0.90                                          
REMARK   3   K_SOL              : NULL                                          
REMARK   3   B_SOL              : NULL                                          
REMARK   3                                                                      
REMARK   3  ERROR ESTIMATES.                                                    
REMARK   3   COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED)     : 0.250            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 25.160           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 28.59                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 43.68                          
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : NULL                                                 
REMARK   3    B22 (A**2) : NULL                                                 
REMARK   3    B33 (A**2) : NULL                                                 
REMARK   3    B12 (A**2) : NULL                                                 
REMARK   3    B13 (A**2) : NULL                                                 
REMARK   3    B23 (A**2) : NULL                                                 
REMARK   3                                                                      
REMARK   3  TWINNING INFORMATION.                                               
REMARK   3   FRACTION: NULL                                                     
REMARK   3   OPERATOR: NULL                                                     
REMARK   3                                                                      
REMARK   3  DEVIATIONS FROM IDEAL VALUES.                                       
REMARK   3                 RMSD          COUNT                                  
REMARK   3   BOND      :   NULL           NULL                                  
REMARK   3   ANGLE     :   NULL           NULL                                  
REMARK   3   CHIRALITY :   NULL           NULL                                  
REMARK   3   PLANARITY :   NULL           NULL                                  
REMARK   3   DIHEDRAL  :   NULL           NULL                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 31                                         
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 30 THROUGH 42 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  24.5491 -11.8262   7.3469              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3227 T22:   0.3752                                     
REMARK   3      T33:   0.4187 T12:   0.0873                                     
REMARK   3      T13:  -0.0171 T23:  -0.1061                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.0671 L22:   5.3586                                     
REMARK   3      L33:   2.8957 L12:   0.6992                                     
REMARK   3      L13:  -2.8952 L23:   0.3364                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1680 S12:   0.1108 S13:  -0.3446                       
REMARK   3      S21:  -0.3574 S22:   0.2635 S23:  -0.6712                       
REMARK   3      S31:   0.0737 S32:   0.7708 S33:  -0.1053                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 43 THROUGH 56 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  -3.8139  -2.8930  15.0390              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2571 T22:   0.3276                                     
REMARK   3      T33:   0.4325 T12:  -0.0021                                     
REMARK   3      T13:  -0.0121 T23:  -0.0628                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   9.9529 L22:   0.6136                                     
REMARK   3      L33:   0.6321 L12:  -1.3575                                     
REMARK   3      L13:  -1.3020 L23:   0.4143                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0795 S12:   0.3886 S13:  -0.2459                       
REMARK   3      S21:  -0.0264 S22:  -0.1280 S23:   0.3818                       
REMARK   3      S31:   0.0518 S32:  -0.4415 S33:   0.1726                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 57 THROUGH 66 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):   1.1537  -6.9852  12.0786              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2618 T22:   0.2528                                     
REMARK   3      T33:   0.5462 T12:  -0.0410                                     
REMARK   3      T13:  -0.0337 T23:  -0.1360                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.7010 L22:   0.0681                                     
REMARK   3      L33:   2.6172 L12:  -0.4524                                     
REMARK   3      L13:  -4.2771 L23:   0.1966                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0724 S12:   0.5102 S13:   0.1124                       
REMARK   3      S21:   0.0256 S22:  -0.2437 S23:   0.5583                       
REMARK   3      S31:  -0.2958 S32:  -0.6703 S33:   0.2336                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 67 THROUGH 95 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):   8.6493   0.4793  10.4727              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2002 T22:   0.1627                                     
REMARK   3      T33:   0.2468 T12:  -0.0199                                     
REMARK   3      T13:  -0.0305 T23:  -0.0247                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.7375 L22:   2.7050                                     
REMARK   3      L33:   3.1442 L12:  -0.6995                                     
REMARK   3      L13:  -0.9348 L23:   0.3024                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0239 S12:   0.1708 S13:  -0.1545                       
REMARK   3      S21:  -0.1525 S22:  -0.0173 S23:   0.2620                       
REMARK   3      S31:  -0.1462 S32:  -0.1752 S33:   0.0266                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 96 THROUGH 110 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):   2.6443 -10.9147  25.8141              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3824 T22:   0.2466                                     
REMARK   3      T33:   0.3031 T12:   0.0144                                     
REMARK   3      T13:   0.0766 T23:   0.0328                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   6.7869 L22:   3.5575                                     
REMARK   3      L33:   2.2640 L12:   0.6974                                     
REMARK   3      L13:  -2.0322 L23:   0.5678                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0637 S12:  -0.0713 S13:  -0.5168                       
REMARK   3      S21:   0.5930 S22:   0.0111 S23:   0.2895                       
REMARK   3      S31:   0.5426 S32:  -0.6825 S33:   0.0421                       
REMARK   3   TLS GROUP : 6                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 111 THROUGH 195 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  12.2217   3.8412  25.5615              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2114 T22:   0.1449                                     
REMARK   3      T33:   0.2190 T12:  -0.0033                                     
REMARK   3      T13:  -0.0102 T23:  -0.0309                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7089 L22:   2.5913                                     
REMARK   3      L33:   3.0777 L12:  -0.1894                                     
REMARK   3      L13:  -0.5032 L23:  -0.0976                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0204 S12:  -0.2242 S13:   0.0618                       
REMARK   3      S21:   0.3278 S22:   0.0439 S23:  -0.0015                       
REMARK   3      S31:  -0.1244 S32:   0.1253 S33:  -0.0073                       
REMARK   3   TLS GROUP : 7                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 196 THROUGH 217 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   5.1775   1.0463  35.9222              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4124 T22:   0.3081                                     
REMARK   3      T33:   0.4049 T12:   0.0138                                     
REMARK   3      T13:   0.1160 T23:  -0.0625                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.9328 L22:   6.1739                                     
REMARK   3      L33:   4.2433 L12:   2.3820                                     
REMARK   3      L13:  -0.0355 L23:   0.6120                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2501 S12:  -0.4991 S13:   0.8436                       
REMARK   3      S21:   0.8388 S22:  -0.3587 S23:   1.1292                       
REMARK   3      S31:  -0.2760 S32:  -0.8220 S33:  -0.0597                       
REMARK   3   TLS GROUP : 8                                                      
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 31 THROUGH 42 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  38.9964   4.4646  68.9868              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2895 T22:   0.3693                                     
REMARK   3      T33:   0.4253 T12:  -0.0040                                     
REMARK   3      T13:  -0.1023 T23:   0.0422                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.6655 L22:   5.2290                                     
REMARK   3      L33:   4.2509 L12:  -0.9382                                     
REMARK   3      L13:   1.6749 L23:  -3.4389                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.4116 S12:  -0.1168 S13:  -0.3200                       
REMARK   3      S21:   0.1198 S22:  -0.6095 S23:  -0.4952                       
REMARK   3      S31:   0.7003 S32:   0.3775 S33:  -0.1521                       
REMARK   3   TLS GROUP : 9                                                      
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 43 THROUGH 66 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  27.0970  28.4005  62.5589              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2598 T22:   0.2907                                     
REMARK   3      T33:   0.4240 T12:   0.0051                                     
REMARK   3      T13:  -0.0627 T23:  -0.0050                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.3897 L22:   6.4344                                     
REMARK   3      L33:   0.5030 L12:  -2.0330                                     
REMARK   3      L13:  -0.2987 L23:  -0.2036                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0011 S12:   0.1381 S13:   0.4627                       
REMARK   3      S21:   0.2073 S22:  -0.2131 S23:  -0.2212                       
REMARK   3      S31:  -0.3133 S32:  -0.1166 S33:   0.2367                       
REMARK   3   TLS GROUP : 10                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 67 THROUGH 95 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  24.1768  17.0557  66.2749              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1573 T22:   0.2120                                     
REMARK   3      T33:   0.2287 T12:  -0.0009                                     
REMARK   3      T13:  -0.0314 T23:  -0.0237                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.0392 L22:   2.3097                                     
REMARK   3      L33:   3.4112 L12:  -0.0139                                     
REMARK   3      L13:   0.2975 L23:  -0.7658                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0197 S12:  -0.2906 S13:   0.0316                       
REMARK   3      S21:   0.2151 S22:  -0.0161 S23:   0.1042                       
REMARK   3      S31:  -0.2690 S32:  -0.1900 S33:   0.0472                       
REMARK   3   TLS GROUP : 11                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 96 THROUGH 110 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):  33.8765  24.9385  50.7605              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2602 T22:   0.2742                                     
REMARK   3      T33:   0.3430 T12:  -0.0634                                     
REMARK   3      T13:   0.0114 T23:   0.0475                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.3384 L22:   4.4343                                     
REMARK   3      L33:   9.2359 L12:   1.0007                                     
REMARK   3      L13:   0.1522 L23:  -0.9720                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1596 S12:   0.1362 S13:   0.3971                       
REMARK   3      S21:  -0.0980 S22:   0.0726 S23:  -0.2308                       
REMARK   3      S31:  -0.9928 S32:  -0.0480 S33:   0.1210                       
REMARK   3   TLS GROUP : 12                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 111 THROUGH 125 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  12.6298  16.1690  53.5291              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2072 T22:   0.4155                                     
REMARK   3      T33:   0.3584 T12:  -0.0405                                     
REMARK   3      T13:  -0.0332 T23:  -0.0230                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.8770 L22:   0.8052                                     
REMARK   3      L33:   2.4874 L12:  -0.1511                                     
REMARK   3      L13:  -1.7866 L23:   0.0497                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0226 S12:   0.1665 S13:   0.3615                       
REMARK   3      S21:  -0.1843 S22:   0.0045 S23:   0.4807                       
REMARK   3      S31:  -0.1130 S32:  -0.5353 S33:  -0.0367                       
REMARK   3   TLS GROUP : 13                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 126 THROUGH 172 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  25.1900  14.1955  53.1952              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1421 T22:   0.2127                                     
REMARK   3      T33:   0.2241 T12:  -0.0144                                     
REMARK   3      T13:  -0.0150 T23:  -0.0022                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.0044 L22:   2.7173                                     
REMARK   3      L33:   3.1980 L12:   0.1347                                     
REMARK   3      L13:   0.0447 L23:  -0.4079                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0042 S12:   0.2344 S13:   0.0166                       
REMARK   3      S21:  -0.2628 S22:  -0.0616 S23:  -0.0613                       
REMARK   3      S31:   0.1143 S32:  -0.0256 S33:   0.0764                       
REMARK   3   TLS GROUP : 14                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 173 THROUGH 186 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  25.1348   7.1030  45.1771              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3272 T22:   0.2756                                     
REMARK   3      T33:   0.2000 T12:  -0.0161                                     
REMARK   3      T13:  -0.0268 T23:  -0.0920                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.6240 L22:   4.7504                                     
REMARK   3      L33:   5.2126 L12:   0.2778                                     
REMARK   3      L13:  -2.7950 L23:  -0.4003                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1018 S12:   0.9028 S13:  -0.2673                       
REMARK   3      S21:  -0.3838 S22:  -0.0918 S23:   0.0559                       
REMARK   3      S31:   0.4299 S32:  -0.5336 S33:   0.0917                       
REMARK   3   TLS GROUP : 15                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 187 THROUGH 217 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  19.6522  15.6772  42.6426              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2781 T22:   0.3824                                     
REMARK   3      T33:   0.3029 T12:  -0.0381                                     
REMARK   3      T13:  -0.0578 T23:  -0.0001                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.3332 L22:   3.2929                                     
REMARK   3      L33:   3.6627 L12:   2.5929                                     
REMARK   3      L13:  -0.8205 L23:  -0.9467                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1906 S12:   0.6737 S13:   0.2436                       
REMARK   3      S21:  -0.5219 S22:   0.3438 S23:   0.2647                       
REMARK   3      S31:   0.0998 S32:  -0.1720 S33:  -0.1826                       
REMARK   3   TLS GROUP : 16                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 28 THROUGH 55 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  14.1771   9.8796  81.1133              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2029 T22:   0.4152                                     
REMARK   3      T33:   0.3123 T12:   0.0645                                     
REMARK   3      T13:  -0.0419 T23:   0.0207                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.1995 L22:   3.0754                                     
REMARK   3      L33:   3.9747 L12:   0.2425                                     
REMARK   3      L13:  -0.2452 L23:  -0.0745                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.3160 S12:  -0.6775 S13:  -0.3492                       
REMARK   3      S21:   0.2408 S22:  -0.2543 S23:   0.0221                       
REMARK   3      S31:  -0.0129 S32:   0.4154 S33:  -0.0357                       
REMARK   3   TLS GROUP : 17                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 56 THROUGH 66 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  10.4216  -2.0871  83.5981              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3345 T22:   0.5783                                     
REMARK   3      T33:   0.5822 T12:   0.1052                                     
REMARK   3      T13:   0.0392 T23:   0.0612                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.9284 L22:   8.1236                                     
REMARK   3      L33:   0.8103 L12:   3.0713                                     
REMARK   3      L13:   0.6512 L23:   0.3248                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0348 S12:  -0.2623 S13:  -1.0391                       
REMARK   3      S21:   0.0986 S22:  -0.2231 S23:   0.1308                       
REMARK   3      S31:   0.5716 S32:   0.4463 S33:   0.1067                       
REMARK   3   TLS GROUP : 18                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 67 THROUGH 95 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):   5.0372   8.1200  81.0677              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2099 T22:   0.4744                                     
REMARK   3      T33:   0.2945 T12:  -0.0280                                     
REMARK   3      T13:  -0.0186 T23:   0.0591                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9753 L22:   2.0170                                     
REMARK   3      L33:   2.7335 L12:   0.2588                                     
REMARK   3      L13:  -0.3125 L23:  -0.7716                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0127 S12:  -0.1053 S13:  -0.3974                       
REMARK   3      S21:  -0.0718 S22:   0.1415 S23:   0.0859                       
REMARK   3      S31:   0.2448 S32:  -0.2298 S33:  -0.1144                       
REMARK   3   TLS GROUP : 19                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 96 THROUGH 110 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):  15.0439   0.1936  96.9479              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4211 T22:   0.7841                                     
REMARK   3      T33:   0.3866 T12:  -0.0251                                     
REMARK   3      T13:  -0.0913 T23:   0.1685                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.5189 L22:   5.3271                                     
REMARK   3      L33:   2.2458 L12:  -0.3807                                     
REMARK   3      L13:  -2.2301 L23:  -0.8901                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0458 S12:  -0.4857 S13:  -0.2509                       
REMARK   3      S21:   0.5227 S22:  -0.0418 S23:  -0.1217                       
REMARK   3      S31:   0.6493 S32:   0.2950 S33:  -0.0014                       
REMARK   3   TLS GROUP : 20                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 111 THROUGH 125 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  -6.3551   9.0526  93.7887              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3441 T22:   0.8175                                     
REMARK   3      T33:   0.4068 T12:  -0.0222                                     
REMARK   3      T13:   0.0446 T23:   0.0751                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.9403 L22:   1.9836                                     
REMARK   3      L33:   4.0208 L12:  -1.2919                                     
REMARK   3      L13:   4.2239 L23:  -1.3275                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1644 S12:  -0.5103 S13:  -0.1644                       
REMARK   3      S21:   0.1952 S22:   0.0724 S23:   0.5075                       
REMARK   3      S31:   0.2005 S32:  -0.4491 S33:  -0.2913                       
REMARK   3   TLS GROUP : 21                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 126 THROUGH 155 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   7.3409  14.1658  92.0456              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2866 T22:   0.5954                                     
REMARK   3      T33:   0.2453 T12:  -0.0021                                     
REMARK   3      T13:   0.0299 T23:   0.0390                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.8780 L22:   2.8261                                     
REMARK   3      L33:   3.1672 L12:  -0.1419                                     
REMARK   3      L13:  -0.5235 L23:  -0.5063                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0981 S12:  -0.7535 S13:  -0.1344                       
REMARK   3      S21:   0.3630 S22:  -0.0099 S23:   0.0447                       
REMARK   3      S31:  -0.4569 S32:  -0.1591 S33:  -0.0481                       
REMARK   3   TLS GROUP : 22                                                     
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 156 THROUGH 217 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   3.3888  10.5511 101.8306              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3669 T22:   0.7048                                     
REMARK   3      T33:   0.2777 T12:  -0.0255                                     
REMARK   3      T13:   0.0647 T23:   0.0420                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.1110 L22:   2.5303                                     
REMARK   3      L33:   3.0891 L12:   0.0651                                     
REMARK   3      L13:   0.8112 L23:  -0.3771                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0035 S12:  -0.8367 S13:   0.0536                       
REMARK   3      S21:   0.6861 S22:  -0.0516 S23:   0.3257                       
REMARK   3      S31:  -0.0578 S32:  -0.2020 S33:   0.0125                       
REMARK   3   TLS GROUP : 23                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 29 THROUGH 42 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):   4.3965   3.1499  -1.3727              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4536 T22:   0.3409                                     
REMARK   3      T33:   0.2424 T12:  -0.0561                                     
REMARK   3      T13:  -0.0808 T23:  -0.0289                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.9179 L22:   4.3571                                     
REMARK   3      L33:   3.8756 L12:   0.2496                                     
REMARK   3      L13:  -3.0165 L23:  -2.7199                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2420 S12:   0.1220 S13:  -0.2818                       
REMARK   3      S21:  -0.3961 S22:   0.2853 S23:   0.1215                       
REMARK   3      S31:   0.4918 S32:  -0.7926 S33:  -0.1140                       
REMARK   3   TLS GROUP : 24                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 43 THROUGH 60 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  26.1842  22.5711  -8.3100              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3835 T22:   0.4102                                     
REMARK   3      T33:   0.5980 T12:   0.0724                                     
REMARK   3      T13:   0.1658 T23:   0.0290                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.7313 L22:   5.6875                                     
REMARK   3      L33:   3.6736 L12:   3.4415                                     
REMARK   3      L13:   0.0944 L23:   0.0705                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0665 S12:   0.3894 S13:   0.2832                       
REMARK   3      S21:  -0.7533 S22:   0.0037 S23:  -1.2504                       
REMARK   3      S31:   0.1696 S32:   0.9601 S33:  -0.0454                       
REMARK   3   TLS GROUP : 25                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 61 THROUGH 95 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  14.5889  19.8476  -4.1650              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4315 T22:   0.2053                                     
REMARK   3      T33:   0.2455 T12:   0.0472                                     
REMARK   3      T13:   0.0146 T23:  -0.0085                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.2120 L22:   3.5645                                     
REMARK   3      L33:   2.2529 L12:   0.6417                                     
REMARK   3      L13:  -0.7263 L23:  -0.5985                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0687 S12:  -0.1949 S13:   0.1012                       
REMARK   3      S21:  -0.1408 S22:  -0.1031 S23:  -0.2487                       
REMARK   3      S31:  -0.0989 S32:   0.2026 S33:   0.0166                       
REMARK   3   TLS GROUP : 26                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 96 THROUGH 110 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):  23.0984  12.9088 -20.2626              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.7812 T22:   0.4446                                     
REMARK   3      T33:   0.4743 T12:   0.0471                                     
REMARK   3      T13:   0.2154 T23:  -0.0329                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.9314 L22:   1.5843                                     
REMARK   3      L33:   1.9329 L12:  -0.2981                                     
REMARK   3      L13:  -0.5383 L23:   0.3063                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0724 S12:   0.5105 S13:   0.2771                       
REMARK   3      S21:  -0.8459 S22:   0.1649 S23:  -0.7493                       
REMARK   3      S31:   0.3540 S32:   1.0318 S33:  -0.0921                       
REMARK   3   TLS GROUP : 27                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 111 THROUGH 125 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   9.9335  31.9026 -17.0371              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.8845 T22:   0.2510                                     
REMARK   3      T33:   0.3905 T12:   0.0426                                     
REMARK   3      T13:   0.0472 T23:   0.0245                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.7986 L22:   1.0827                                     
REMARK   3      L33:   2.0321 L12:   0.0230                                     
REMARK   3      L13:  -0.3712 L23:   0.0401                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2589 S12:   0.1197 S13:   0.3174                       
REMARK   3      S21:  -0.5652 S22:  -0.2768 S23:  -0.0837                       
REMARK   3      S31:  -0.4064 S32:  -0.1768 S33:  -0.1014                       
REMARK   3   TLS GROUP : 28                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 126 THROUGH 155 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   7.9477  17.6526 -15.1990              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6556 T22:   0.2537                                     
REMARK   3      T33:   0.2155 T12:  -0.0422                                     
REMARK   3      T13:  -0.0100 T23:  -0.0044                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.9628 L22:   0.8973                                     
REMARK   3      L33:   3.6913 L12:  -0.5084                                     
REMARK   3      L13:   0.2873 L23:   0.8981                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0147 S12:   0.3445 S13:  -0.0685                       
REMARK   3      S21:  -1.1578 S22:   0.0811 S23:  -0.1202                       
REMARK   3      S31:   0.1657 S32:  -0.4826 S33:  -0.0126                       
REMARK   3   TLS GROUP : 29                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 156 THROUGH 172 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  15.7462  22.6354 -21.2309              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   1.1341 T22:   0.3315                                     
REMARK   3      T33:   0.1379 T12:   0.0005                                     
REMARK   3      T13:   0.2221 T23:   0.0572                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.0667 L22:   0.1732                                     
REMARK   3      L33:   1.1176 L12:  -0.6600                                     
REMARK   3      L13:   0.1320 L23:   0.0530                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0044 S12:   0.5474 S13:   0.4720                       
REMARK   3      S21:  -1.3599 S22:  -0.1763 S23:  -0.4921                       
REMARK   3      S31:   0.1177 S32:   0.3307 S33:  -0.4393                       
REMARK   3   TLS GROUP : 30                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 173 THROUGH 195 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   3.0046  21.7069 -24.4959              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.9845 T22:   0.4729                                     
REMARK   3      T33:   0.2288 T12:   0.0633                                     
REMARK   3      T13:  -0.1899 T23:   0.0655                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.3410 L22:   1.6998                                     
REMARK   3      L33:   2.2002 L12:   0.5137                                     
REMARK   3      L13:  -1.7063 L23:   1.0976                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.5805 S12:   0.6949 S13:   0.1021                       
REMARK   3      S21:  -1.4606 S22:   0.1316 S23:   0.7640                       
REMARK   3      S31:   0.4041 S32:  -0.9005 S33:   0.0732                       
REMARK   3   TLS GROUP : 31                                                     
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 196 THROUGH 217 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  16.0421  22.7317 -29.7538              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   1.0355 T22:   0.5884                                     
REMARK   3      T33:   0.2590 T12:   0.0480                                     
REMARK   3      T13:   0.1080 T23:   0.0883                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.7547 L22:   3.3841                                     
REMARK   3      L33:   1.9449 L12:  -2.5677                                     
REMARK   3      L13:   1.9788 L23:  -0.2196                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.3196 S12:   0.5902 S13:   0.2187                       
REMARK   3      S21:  -1.0686 S22:  -0.3460 S23:  -0.7139                       
REMARK   3      S31:  -0.2186 S32:   0.7723 S33:   0.0387                       
REMARK   3                                                                      
REMARK   3  NCS DETAILS                                                         
REMARK   3   NUMBER OF NCS GROUPS : NULL                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 6U09 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-AUG-19.                  
REMARK 100 THE DEPOSITION ID IS D_1000243664.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 30-JUN-18                          
REMARK 200  TEMPERATURE           (KELVIN) : 80                                 
REMARK 200  PH                             : 7.2                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : ALS                                
REMARK 200  BEAMLINE                       : 8.3.1                              
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 1.12011                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : PIXEL                              
REMARK 200  DETECTOR MANUFACTURER          : DECTRIS PILATUS3 S 6M              
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : XDS                                
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 202752                             
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.130                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 146.990                            
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 66.2                               
REMARK 200  DATA REDUNDANCY                : 3.300                              
REMARK 200  R MERGE                    (I) : 0.06900                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 5.3000                             
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.13                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.15                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 1.0                                
REMARK 200  DATA REDUNDANCY IN SHELL       : 1.70                               
REMARK 200  R MERGE FOR SHELL          (I) : 2.29300                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHENIX                                                
REMARK 200 STARTING MODEL: 4DT6                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 46.84                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.31                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: HEPES, MPD, PEG 6K, NDSB-256, PH 7.2,    
REMARK 280  BATCH MODE, TEMPERATURE 298K                                        
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1                              
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1, 2, 3, 4                                              
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 2                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: B                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 3                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: C                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 4                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: D                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 465                                                                      
REMARK 465 MISSING RESIDUES                                                     
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                
REMARK 465                                                                      
REMARK 465   M RES C SSSEQI                                                     
REMARK 465     VAL A    28                                                      
REMARK 465     ALA A    29                                                      
REMARK 465     THR A   205                                                      
REMARK 465     LYS A   206                                                      
REMARK 465     SER A   207                                                      
REMARK 465     GLY A   208                                                      
REMARK 465     SER A   209                                                      
REMARK 465     THR A   210                                                      
REMARK 465     VAL B    28                                                      
REMARK 465     ALA B    29                                                      
REMARK 465     ASN B    30                                                      
REMARK 465     THR B   205                                                      
REMARK 465     LYS B   206                                                      
REMARK 465     SER B   207                                                      
REMARK 465     GLY B   208                                                      
REMARK 465     SER B   209                                                      
REMARK 465     THR B   210                                                      
REMARK 465     LYS C   206                                                      
REMARK 465     SER C   207                                                      
REMARK 465     GLY C   208                                                      
REMARK 465     SER C   209                                                      
REMARK 465     THR C   210                                                      
REMARK 465     THR C   211                                                      
REMARK 465     VAL D    28                                                      
REMARK 465     SER D   207                                                      
REMARK 465     GLY D   208                                                      
REMARK 465     SER D   209                                                      
REMARK 465     THR D   210                                                      
REMARK 465     THR D   211                                                      
REMARK 465     LYS D   212                                                      
REMARK 470                                                                      
REMARK 470 MISSING ATOM                                                         
REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;           
REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;          
REMARK 470 I=INSERTION CODE):                                                   
REMARK 470   M RES CSSEQI  ATOMS                                                
REMARK 470     GLU A  32    CG   CD   OE1  OE2                                  
REMARK 470     GLN A  57    CG   CD   OE1  NE2                                  
REMARK 470     ARG A 109    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     THR A 211    OG1  CG2                                            
REMARK 470     LYS A 212    CG   CD   CE   NZ                                   
REMARK 470     LYS B  49    CG   CD   CE   NZ                                   
REMARK 470     ARG B  61    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     GLU B 105    CG   CD   OE1  OE2                                  
REMARK 470     LYS B 108    CG   CD   CE   NZ                                   
REMARK 470     LYS B 159    CG   CD   CE   NZ                                   
REMARK 470     LYS B 212    CG   CD   CE   NZ                                   
REMARK 470     VAL C  28    CG1  CG2                                            
REMARK 470     GLU C  32    CG   CD   OE1  OE2                                  
REMARK 470     LYS C  49    CG   CD   CE   NZ                                   
REMARK 470     LYS C  52    CG   CD   CE   NZ                                   
REMARK 470     LYS C  54    CG   CD   CE   NZ                                   
REMARK 470     THR C  55    OG1  CG2                                            
REMARK 470     GLN C  57    CG   CD   OE1  NE2                                  
REMARK 470     LYS C 159    CG   CD   CE   NZ                                   
REMARK 470     GLU C 185    CG   CD   OE1  OE2                                  
REMARK 470     LYS C 192    CG   CD   CE   NZ                                   
REMARK 470     GLN C 198    CG   CD   OE1  NE2                                  
REMARK 470     THR C 205    OG1  CG2                                            
REMARK 470     LYS C 212    CG   CD   CE   NZ                                   
REMARK 470     VAL C 216    CG1  CG2                                            
REMARK 470     ASN D  30    CG   OD1  ND2                                       
REMARK 470     GLU D  32    CG   CD   OE1  OE2                                  
REMARK 470     HIS D  33    CG   ND1  CD2  CE1  NE2                             
REMARK 470     ASN D  50    CG   OD1  ND2                                       
REMARK 470     LYS D  52    CG   CD   CE   NZ                                   
REMARK 470     LYS D  54    CG   CD   CE   NZ                                   
REMARK 470     THR D  55    OG1  CG2                                            
REMARK 470     TRP D  56    CG   CD1  CD2  NE1  CE2  CE3  CZ2                   
REMARK 470     TRP D  56    CZ3  CH2                                            
REMARK 470     GLN D  57    CG   CD   OE1  NE2                                  
REMARK 470     LEU D  60    CG   CD1  CD2                                       
REMARK 470     LYS D 119    CG   CD   CE   NZ                                   
REMARK 470     LYS D 159    CG   CD   CE   NZ                                   
REMARK 470     LYS D 192    CG   CD   CE   NZ                                   
REMARK 470     VAL D 194    CG1  CG2                                            
REMARK 470     LYS D 206    CG   CD   CE   NZ                                   
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    ASP A  67       25.39   -147.51                                   
REMARK 500    ASP A 143     -135.55     53.57                                   
REMARK 500    ASP B  67       30.23   -148.32                                   
REMARK 500    ASP B 143     -122.11     46.45                                   
REMARK 500    LYS B 212      131.95   -170.77                                   
REMARK 500    ASP C  67       23.66   -143.88                                   
REMARK 500    ASP C 143     -136.55     61.98                                   
REMARK 500    THR D  55     -153.58   -111.00                                   
REMARK 500    TRP D  56     -129.21     45.70                                   
REMARK 500    ASP D  67       24.23   -145.21                                   
REMARK 500    ASP D 143     -131.40     55.29                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue EI9 A 301                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for Di-peptide EI9 B 301 and LYS B    
REMARK 800  162                                                                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for Di-peptide EI9 C 301 and LYS C    
REMARK 800  162                                                                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for Di-peptide EI9 D 301 and LYS D    
REMARK 800  162                                                                 
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 6U06   RELATED DB: PDB                                   
REMARK 900 THE SAME PROTEIN, DIFFERENT LIGANDS                                  
DBREF  6U09 A   28   217  UNP    P63073   IF4E_MOUSE      28    217             
DBREF  6U09 B   28   217  UNP    P63073   IF4E_MOUSE      28    217             
DBREF  6U09 C   28   217  UNP    P63073   IF4E_MOUSE      28    217             
DBREF  6U09 D   28   217  UNP    P63073   IF4E_MOUSE      28    217             
SEQRES   1 A  190  VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU GLN          
SEQRES   2 A  190  ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS SER          
SEQRES   3 A  190  LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS PHE          
SEQRES   4 A  190  ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS ILE          
SEQRES   5 A  190  GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR SER          
SEQRES   6 A  190  LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP GLU          
SEQRES   7 A  190  LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU ASN          
SEQRES   8 A  190  LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP LEU          
SEQRES   9 A  190  GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP ASP          
SEQRES  10 A  190  TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL ARG          
SEQRES  11 A  190  ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU CYS          
SEQRES  12 A  190  GLU ASN ARG ASP ALA VAL THR HIS ILE GLY ARG VAL TYR          
SEQRES  13 A  190  LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE GLY          
SEQRES  14 A  190  TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY SER          
SEQRES  15 A  190  THR THR LYS ASN ARG PHE VAL VAL                              
SEQRES   1 B  190  VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU GLN          
SEQRES   2 B  190  ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS SER          
SEQRES   3 B  190  LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS PHE          
SEQRES   4 B  190  ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS ILE          
SEQRES   5 B  190  GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR SER          
SEQRES   6 B  190  LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP GLU          
SEQRES   7 B  190  LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU ASN          
SEQRES   8 B  190  LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP LEU          
SEQRES   9 B  190  GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP ASP          
SEQRES  10 B  190  TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL ARG          
SEQRES  11 B  190  ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU CYS          
SEQRES  12 B  190  GLU ASN ARG ASP ALA VAL THR HIS ILE GLY ARG VAL TYR          
SEQRES  13 B  190  LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE GLY          
SEQRES  14 B  190  TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY SER          
SEQRES  15 B  190  THR THR LYS ASN ARG PHE VAL VAL                              
SEQRES   1 C  190  VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU GLN          
SEQRES   2 C  190  ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS SER          
SEQRES   3 C  190  LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS PHE          
SEQRES   4 C  190  ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS ILE          
SEQRES   5 C  190  GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR SER          
SEQRES   6 C  190  LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP GLU          
SEQRES   7 C  190  LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU ASN          
SEQRES   8 C  190  LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP LEU          
SEQRES   9 C  190  GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP ASP          
SEQRES  10 C  190  TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL ARG          
SEQRES  11 C  190  ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU CYS          
SEQRES  12 C  190  GLU ASN ARG ASP ALA VAL THR HIS ILE GLY ARG VAL TYR          
SEQRES  13 C  190  LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE GLY          
SEQRES  14 C  190  TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY SER          
SEQRES  15 C  190  THR THR LYS ASN ARG PHE VAL VAL                              
SEQRES   1 D  190  VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU GLN          
SEQRES   2 D  190  ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS SER          
SEQRES   3 D  190  LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS PHE          
SEQRES   4 D  190  ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS ILE          
SEQRES   5 D  190  GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR SER          
SEQRES   6 D  190  LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP GLU          
SEQRES   7 D  190  LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU ASN          
SEQRES   8 D  190  LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP LEU          
SEQRES   9 D  190  GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP ASP          
SEQRES  10 D  190  TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL ARG          
SEQRES  11 D  190  ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU CYS          
SEQRES  12 D  190  GLU ASN ARG ASP ALA VAL THR HIS ILE GLY ARG VAL TYR          
SEQRES  13 D  190  LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE GLY          
SEQRES  14 D  190  TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY SER          
SEQRES  15 D  190  THR THR LYS ASN ARG PHE VAL VAL                              
HET    EI9  A 301      31                                                       
HET    EI9  B 301      31                                                       
HET    EI9  C 301      31                                                       
HET    EI9  D 301      31                                                       
HETNAM     EI9 3-{(1-OXO-1,2-DIHYDROISOQUINOLIN-7-YL)[(PYRIDIN-4-YL)            
HETNAM   2 EI9  METHYL]SULFAMOYL}BENZENE-1-SULFONYL FLUORIDE                    
FORMUL   5  EI9    4(C21 H16 F N3 O5 S2)                                        
FORMUL   9  HOH   *243(H2 O)                                                    
HELIX    1 AA1 ASN A   30  TYR A   34  5                                   5    
HELIX    2 AA2 TRP A   56  ALA A   58  5                                   3    
HELIX    3 AA3 VAL A   69  ASN A   77  1                                   9    
HELIX    4 AA4 LEU A   81  LEU A   85  5                                   5    
HELIX    5 AA5 GLN A  120  ASP A  125  1                                   6    
HELIX    6 AA6 ASP A  125  GLY A  139  1                                  15    
HELIX    7 AA7 PHE A  142  ASP A  147  5                                   6    
HELIX    8 AA8 ASN A  172  LEU A  187  1                                  16    
HELIX    9 AA9 HIS A  200  ALA A  204  1                                   5    
HELIX   10 AB1 THR B   55  ASN B   59  1                                   5    
HELIX   11 AB2 VAL B   69  ILE B   79  1                                  11    
HELIX   12 AB3 LEU B   81  LEU B   85  5                                   5    
HELIX   13 AB4 GLN B  120  ASP B  125  1                                   6    
HELIX   14 AB5 ASP B  125  GLY B  139  1                                  15    
HELIX   15 AB6 PHE B  142  ASP B  147  5                                   6    
HELIX   16 AB7 ASN B  172  LEU B  187  1                                  16    
HELIX   17 AB8 HIS B  200  ALA B  204  1                                   5    
HELIX   18 AB9 ASN C   30  ILE C   35  1                                   6    
HELIX   19 AC1 TRP C   56  ALA C   58  5                                   3    
HELIX   20 AC2 VAL C   69  ILE C   79  1                                  11    
HELIX   21 AC3 LEU C   81  LEU C   85  5                                   5    
HELIX   22 AC4 GLN C  120  ASP C  125  1                                   6    
HELIX   23 AC5 ASP C  125  GLY C  139  1                                  15    
HELIX   24 AC6 PHE C  142  ASP C  147  5                                   6    
HELIX   25 AC7 ASN C  172  GLY C  188  1                                  17    
HELIX   26 AC8 HIS C  200  ALA C  204  1                                   5    
HELIX   27 AC9 ASN D   30  ILE D   35  1                                   6    
HELIX   28 AD1 THR D   55  ASN D   59  5                                   5    
HELIX   29 AD2 VAL D   69  ASN D   77  1                                   9    
HELIX   30 AD3 LEU D   81  LEU D   85  5                                   5    
HELIX   31 AD4 GLN D  120  ASP D  125  1                                   6    
HELIX   32 AD5 ASP D  125  GLY D  139  1                                  15    
HELIX   33 AD6 PHE D  142  ASP D  147  5                                   6    
HELIX   34 AD7 ASN D  172  GLY D  188  1                                  17    
HELIX   35 AD8 HIS D  200  THR D  205  1                                   6    
SHEET    1 AA1 8 LEU A  60  THR A  68  0                                        
SHEET    2 AA1 8 PRO A  38  PHE A  48 -1  N  PHE A  47   O  ARG A  61           
SHEET    3 AA1 8 ASP A  90  LYS A  95 -1  O  PHE A  94   N  ALA A  44           
SHEET    4 AA1 8 VAL A 149  ASN A 155 -1  O  ALA A 152   N  LEU A  93           
SHEET    5 AA1 8 LYS A 162  THR A 167 -1  O  TRP A 166   N  CYS A 150           
SHEET    6 AA1 8 GLY A 111  THR A 116 -1  N  ILE A 115   O  ILE A 163           
SHEET    7 AA1 8 GLY A 196  SER A 199 -1  O  GLN A 198   N  ARG A 112           
SHEET    8 AA1 8 PHE A 215  VAL A 216 -1  O  PHE A 215   N  TYR A 197           
SHEET    1 AA2 8 LEU B  60  THR B  68  0                                        
SHEET    2 AA2 8 PRO B  38  PHE B  48 -1  N  LEU B  45   O  ILE B  63           
SHEET    3 AA2 8 ASP B  90  LYS B  95 -1  O  SER B  92   N  TRP B  46           
SHEET    4 AA2 8 VAL B 149  ASN B 155 -1  O  CYS B 150   N  LYS B  95           
SHEET    5 AA2 8 LYS B 162  THR B 167 -1  O  TRP B 166   N  CYS B 150           
SHEET    6 AA2 8 GLY B 111  THR B 116 -1  N  ILE B 115   O  ILE B 163           
SHEET    7 AA2 8 GLY B 196  SER B 199 -1  O  GLY B 196   N  LEU B 114           
SHEET    8 AA2 8 PHE B 215  VAL B 216 -1  O  PHE B 215   N  TYR B 197           
SHEET    1 AA3 8 LEU C  60  THR C  68  0                                        
SHEET    2 AA3 8 PRO C  38  PHE C  48 -1  N  PHE C  47   O  ARG C  61           
SHEET    3 AA3 8 ASP C  90  LYS C  95 -1  O  SER C  92   N  TRP C  46           
SHEET    4 AA3 8 VAL C 149  ASN C 155 -1  O  VAL C 154   N  TYR C  91           
SHEET    5 AA3 8 LYS C 162  THR C 167 -1  O  TRP C 166   N  GLY C 151           
SHEET    6 AA3 8 GLY C 111  THR C 116 -1  N  ILE C 115   O  ILE C 163           
SHEET    7 AA3 8 ILE C 195  SER C 199 -1  O  GLY C 196   N  LEU C 114           
SHEET    8 AA3 8 PHE C 215  VAL C 217 -1  O  PHE C 215   N  TYR C 197           
SHEET    1 AA4 8 ARG D  61  THR D  68  0                                        
SHEET    2 AA4 8 PRO D  38  LYS D  49 -1  N  PHE D  47   O  ARG D  61           
SHEET    3 AA4 8 CYS D  89  LYS D  95 -1  O  SER D  92   N  TRP D  46           
SHEET    4 AA4 8 VAL D 149  ASN D 155 -1  O  ALA D 152   N  LEU D  93           
SHEET    5 AA4 8 ASP D 161  THR D 167 -1  O  TRP D 166   N  GLY D 151           
SHEET    6 AA4 8 GLY D 111  LEU D 117 -1  N  ILE D 115   O  ILE D 163           
SHEET    7 AA4 8 GLY D 196  SER D 199 -1  O  GLN D 198   N  ARG D 112           
SHEET    8 AA4 8 PHE D 215  VAL D 216 -1  O  PHE D 215   N  TYR D 197           
LINK         NZ  LYS A 162                 S2  EI9 A 301     1555   1555  1.60  
LINK         NZ  LYS B 162                 S2  EI9 B 301     1555   1555  1.60  
LINK         NZ  LYS C 162                 S2  EI9 C 301     1555   1555  1.60  
LINK         NZ  LYS D 162                 S2  EI9 D 301     1555   1555  1.60  
SITE     1 AC1 14 TRP A  56  ASP A  90  SER A  92  PRO A 100                    
SITE     2 AC1 14 MET A 101  TRP A 102  GLU A 103  ARG A 112                    
SITE     3 AC1 14 VAL A 153  ASN A 155  ARG A 157  LYS A 162                    
SITE     4 AC1 14 TRP A 166  HOH A 413                                          
SITE     1 AC2 17 TRP B  56  ASP B  90  SER B  92  PRO B 100                    
SITE     2 AC2 17 MET B 101  TRP B 102  GLU B 103  ARG B 112                    
SITE     3 AC2 17 ILE B 115  VAL B 153  VAL B 154  ASN B 155                    
SITE     4 AC2 17 ARG B 157  ASP B 161  ILE B 163  TRP B 166                    
SITE     5 AC2 17 HOH B 442                                                     
SITE     1 AC3 14 TRP C  56  ASP C  90  SER C  92  PRO C 100                    
SITE     2 AC3 14 MET C 101  TRP C 102  GLU C 103  ARG C 112                    
SITE     3 AC3 14 ILE C 115  VAL C 154  ASN C 155  ARG C 157                    
SITE     4 AC3 14 ASP C 161  ILE C 163                                          
SITE     1 AC4 14 ASP D  90  SER D  92  PRO D 100  MET D 101                    
SITE     2 AC4 14 TRP D 102  GLU D 103  ARG D 112  ILE D 115                    
SITE     3 AC4 14 VAL D 154  ASN D 155  ARG D 157  ASP D 161                    
SITE     4 AC4 14 ILE D 163  TRP D 166                                          
CRYST1   38.100   38.240  147.790  95.50  87.28 101.85 P 1           4          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      0.026247  0.005505 -0.000767        0.00000                         
SCALE2      0.000000  0.026720  0.002360        0.00000                         
SCALE3      0.000000  0.000000  0.006800        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
DBGET integrated database retrieval system