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Entry: 4TQC
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HEADER    PROTEIN BINDING                         10-JUN-14   4TQC              
TITLE     THE CO-COMPLEX STRUCTURE OF THE TRANSLATION INITIATION FACTOR EIF4E   
TITLE    2 WITH THE INHIBITOR 4EGI-1 REVEALS AN ALLOSTERIC MECHANISM FOR        
TITLE    3 DISSOCIATING EIF4G                                                   
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: EUKARYOTIC TRANSLATION INITIATION FACTOR 4E;               
COMPND   3 CHAIN: A, B;                                                         
COMPND   4 FRAGMENT: UNP RESIDUES 28-217;                                       
COMPND   5 SYNONYM: EIF4E,EIF-4F 25 KDA SUBUNIT,MRNA CAP-BINDING PROTEIN;       
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 ORGANISM_TAXID: 9606;                                                
SOURCE   5 GENE: EIF4E, EIF4EL1, EIF4F;                                         
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 511693;                                     
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21                                       
KEYWDS    EIF4E, TRANSLATION INITIATION INHIBITOR, ALLOSTERIC, 4EGI1, PROTEIN   
KEYWDS   2 BINDING                                                              
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    E.PAPADOPOULOS,S.JENNI,G.WAGNER                                       
REVDAT   4   23-AUG-17 4TQC    1       SOURCE JRNL   REMARK ATOM                
REVDAT   3   01-OCT-14 4TQC    1       JRNL                                     
REVDAT   2   20-AUG-14 4TQC    1       REMARK                                   
REVDAT   1   13-AUG-14 4TQC    0                                                
JRNL        AUTH   E.PAPADOPOULOS,S.JENNI,E.KABHA,K.J.TAKROURI,T.YI,N.SALVI,    
JRNL        AUTH 2 R.E.LUNA,E.GAVATHIOTIS,P.MAHALINGAM,H.ARTHANARI,             
JRNL        AUTH 3 R.RODRIGUEZ-MIAS,R.YEFIDOFF-FREEDMAN,B.H.AKTAS,M.CHOREV,     
JRNL        AUTH 4 J.A.HALPERIN,G.WAGNER                                        
JRNL        TITL   STRUCTURE OF THE EUKARYOTIC TRANSLATION INITIATION FACTOR    
JRNL        TITL 2 EIF4E IN COMPLEX WITH 4EGI-1 REVEALS AN ALLOSTERIC MECHANISM 
JRNL        TITL 3 FOR DISSOCIATING EIF4G.                                      
JRNL        REF    PROC.NATL.ACAD.SCI.USA        V. 111 E3187 2014              
JRNL        REFN                   ESSN 1091-6490                               
JRNL        PMID   25049413                                                     
JRNL        DOI    10.1073/PNAS.1410250111                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.80 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX 1.9_1692                                      
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) : 1.80                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 19.50                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.360                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 93.9                           
REMARK   3   NUMBER OF REFLECTIONS             : 32700                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.163                           
REMARK   3   R VALUE            (WORKING SET) : 0.161                           
REMARK   3   FREE R VALUE                     : 0.194                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 4.380                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 1432                            
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 19.5527 -  3.8757    0.95     3229   153  0.1534 0.1669        
REMARK   3     2  3.8757 -  3.0801    0.97     3218   152  0.1428 0.2048        
REMARK   3     3  3.0801 -  2.6919    0.97     3242   143  0.1588 0.1899        
REMARK   3     4  2.6919 -  2.4463    0.98     3257   159  0.1657 0.1882        
REMARK   3     5  2.4463 -  2.2712    0.98     3258   145  0.1617 0.1987        
REMARK   3     6  2.2712 -  2.1375    0.98     3222   145  0.1687 0.2206        
REMARK   3     7  2.1375 -  2.0306    0.98     3266   150  0.1736 0.2029        
REMARK   3     8  2.0306 -  1.9422    0.98     3250   143  0.1896 0.1961        
REMARK   3     9  1.9422 -  1.8675    0.95     3135   155  0.2004 0.2498        
REMARK   3    10  1.8675 -  1.8000    0.66     2191    87  0.2220 0.2510        
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)     : 0.160            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 20.230           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
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      :  0.004           3105                                  
REMARK   3   ANGLE     :  0.790           4210                                  
REMARK   3   CHIRALITY :  0.030            436                                  
REMARK   3   PLANARITY :  0.002            522                                  
REMARK   3   DIHEDRAL  : 15.054           1130                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 35                                         
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 35:57)                              
REMARK   3    ORIGIN FOR THE GROUP (A):   3.8209  -4.2503  -1.5714              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3371 T22:   0.1627                                     
REMARK   3      T33:   0.2742 T12:   0.0024                                     
REMARK   3      T13:   0.0227 T23:   0.0141                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.3805 L22:   1.2346                                     
REMARK   3      L33:   6.6808 L12:  -0.5484                                     
REMARK   3      L13:   2.6848 L23:  -0.1953                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0577 S12:  -0.0667 S13:   0.1955                       
REMARK   3      S21:  -0.1554 S22:  -0.0736 S23:   0.1231                       
REMARK   3      S31:  -0.4877 S32:  -0.3661 S33:   0.0379                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 58:64)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  -0.5487  -0.3336  -4.7139              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4574 T22:   0.2425                                     
REMARK   3      T33:   0.2658 T12:   0.0872                                     
REMARK   3      T13:  -0.0592 T23:   0.0234                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.6161 L22:   3.9459                                     
REMARK   3      L33:   7.7146 L12:   0.5412                                     
REMARK   3      L13:   4.4381 L23:   1.4975                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.4352 S12:   0.4744 S13:   0.8275                       
REMARK   3      S21:  -0.6436 S22:  -0.2176 S23:  -0.0746                       
REMARK   3      S31:  -0.9719 S32:  -0.1673 S33:  -0.2698                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 65:78)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  10.1155  -1.6697   9.3183              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3677 T22:   0.1733                                     
REMARK   3      T33:   0.2124 T12:  -0.0310                                     
REMARK   3      T13:  -0.0448 T23:   0.0065                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.4756 L22:   2.3382                                     
REMARK   3      L33:   4.8785 L12:   0.1742                                     
REMARK   3      L13:  -0.3135 L23:  -0.4653                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3669 S12:   0.0468 S13:   0.3734                       
REMARK   3      S21:  -0.2183 S22:   0.2494 S23:  -0.0769                       
REMARK   3      S31:  -0.6060 S32:   0.1881 S33:  -0.0945                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 79:87)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  -4.0918  -2.4561  10.1045              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5572 T22:   0.8428                                     
REMARK   3      T33:   0.7796 T12:   0.2049                                     
REMARK   3      T13:  -0.0153 T23:  -0.1236                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   9.3714 L22:   7.6633                                     
REMARK   3      L33:   3.1643 L12:   2.6555                                     
REMARK   3      L13:   2.7955 L23:  -3.2176                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.5755 S12:   0.5642 S13:  -0.6460                       
REMARK   3      S21:   1.0230 S22:   0.0180 S23:   1.0757                       
REMARK   3      S31:  -0.7823 S32:  -2.1995 S33:   0.2176                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 88:104)                             
REMARK   3    ORIGIN FOR THE GROUP (A):   3.4423  -8.5521  -5.3825              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3041 T22:   0.2102                                     
REMARK   3      T33:   0.2019 T12:   0.0517                                     
REMARK   3      T13:  -0.0113 T23:   0.0402                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.9433 L22:   5.4325                                     
REMARK   3      L33:   7.1303 L12:   0.6579                                     
REMARK   3      L13:   1.7610 L23:   0.1790                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0060 S12:   0.2607 S13:   0.1330                       
REMARK   3      S21:  -0.2572 S22:   0.0075 S23:   0.2386                       
REMARK   3      S31:  -0.6891 S32:  -0.3237 S33:   0.0798                       
REMARK   3   TLS GROUP : 6                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 105:109)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   8.9708 -15.0014 -13.6227              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5018 T22:   0.3805                                     
REMARK   3      T33:   0.2649 T12:   0.0377                                     
REMARK   3      T13:   0.0307 T23:  -0.0328                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.0325 L22:   2.1751                                     
REMARK   3      L33:   7.5338 L12:  -1.0433                                     
REMARK   3      L13:  -0.0361 L23:   2.7125                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2545 S12:   0.4595 S13:   0.2720                       
REMARK   3      S21:  -1.2231 S22:   0.0485 S23:  -0.2607                       
REMARK   3      S31:  -0.0165 S32:   1.2586 S33:   0.4154                       
REMARK   3   TLS GROUP : 7                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 110:124)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  -5.0523 -19.3919   6.3617              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2693 T22:   0.5963                                     
REMARK   3      T33:   0.4742 T12:  -0.0719                                     
REMARK   3      T13:   0.0106 T23:   0.0386                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.1494 L22:   6.3217                                     
REMARK   3      L33:   3.6126 L12:  -0.4714                                     
REMARK   3      L13:   1.6778 L23:   0.3608                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0733 S12:  -0.7908 S13:  -0.0177                       
REMARK   3      S21:   0.2019 S22:   0.0854 S23:   1.2773                       
REMARK   3      S31:   0.3351 S32:  -1.4065 S33:   0.4671                       
REMARK   3   TLS GROUP : 8                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 125:141)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   5.8425 -14.1578   9.4443              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1753 T22:   0.1347                                     
REMARK   3      T33:   0.1714 T12:   0.0079                                     
REMARK   3      T13:   0.0252 T23:   0.0282                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.7522 L22:   4.2654                                     
REMARK   3      L33:   6.9089 L12:   0.1294                                     
REMARK   3      L13:  -0.1947 L23:  -0.8658                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0185 S12:  -0.2183 S13:   0.1805                       
REMARK   3      S21:   0.1800 S22:   0.2320 S23:   0.2803                       
REMARK   3      S31:   0.0883 S32:  -0.3232 S33:   0.2048                       
REMARK   3   TLS GROUP : 9                                                      
REMARK   3    SELECTION: (CHAIN A AND RESID 142:147)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  17.7205 -20.2717   0.8100              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2760 T22:   0.4751                                     
REMARK   3      T33:   0.3589 T12:   0.0333                                     
REMARK   3      T13:   0.0764 T23:  -0.1116                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.2899 L22:   7.5674                                     
REMARK   3      L33:   4.5358 L12:  -3.5400                                     
REMARK   3      L13:   0.2226 L23:   0.8990                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0531 S12:   0.3828 S13:  -0.2549                       
REMARK   3      S21:  -0.6141 S22:   0.1526 S23:  -0.5039                       
REMARK   3      S31:  -0.1474 S32:   1.5896 S33:   0.3433                       
REMARK   3   TLS GROUP : 10                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 148:168)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  -0.0646 -15.4197  -0.2515              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1825 T22:   0.2521                                     
REMARK   3      T33:   0.1934 T12:   0.0067                                     
REMARK   3      T13:  -0.0073 T23:   0.0450                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.4867 L22:   3.6186                                     
REMARK   3      L33:   4.0084 L12:  -0.8562                                     
REMARK   3      L13:   1.4662 L23:   0.3020                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0161 S12:  -0.2018 S13:  -0.1613                       
REMARK   3      S21:  -0.0885 S22:   0.1211 S23:   0.3879                       
REMARK   3      S31:   0.0328 S32:  -0.6232 S33:   0.2419                       
REMARK   3   TLS GROUP : 11                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 169:174)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  11.8660 -26.6389  -8.9098              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.8518 T22:   0.4273                                     
REMARK   3      T33:   0.3756 T12:   0.2544                                     
REMARK   3      T13:  -0.0484 T23:  -0.1669                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   6.3099 L22:   5.9143                                     
REMARK   3      L33:   2.2847 L12:  -2.5061                                     
REMARK   3      L13:  -0.1926 L23:  -3.2768                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.7092 S12:   1.0032 S13:  -0.9688                       
REMARK   3      S21:  -1.6522 S22:  -0.0638 S23:  -0.2258                       
REMARK   3      S31:   1.3911 S32:   0.5303 S33:   0.8024                       
REMARK   3   TLS GROUP : 12                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 175:184)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  10.0540 -25.5394   2.9629              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2658 T22:   0.1676                                     
REMARK   3      T33:   0.2084 T12:   0.0239                                     
REMARK   3      T13:  -0.0006 T23:  -0.0305                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.2111 L22:   5.0353                                     
REMARK   3      L33:   3.2754 L12:   0.4766                                     
REMARK   3      L13:  -1.7785 L23:   1.0546                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0432 S12:   0.0580 S13:  -0.6499                       
REMARK   3      S21:  -0.1056 S22:  -0.1414 S23:  -0.1586                       
REMARK   3      S31:   0.8341 S32:   0.0272 S33:   0.1726                       
REMARK   3   TLS GROUP : 13                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 185:189)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   6.5170 -23.6783  11.6083              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2580 T22:   0.3204                                     
REMARK   3      T33:   0.2321 T12:  -0.0123                                     
REMARK   3      T13:  -0.0134 T23:   0.0208                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.8436 L22:   6.0044                                     
REMARK   3      L33:   9.9619 L12:   5.6257                                     
REMARK   3      L13:  -2.3081 L23:   0.1317                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1913 S12:   0.7740 S13:  -0.7508                       
REMARK   3      S21:   1.0343 S22:  -0.0300 S23:  -0.5306                       
REMARK   3      S31:   0.0560 S32:   0.4698 S33:  -0.0163                       
REMARK   3   TLS GROUP : 14                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 190:198)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   0.6556 -28.9602   3.4096              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6428 T22:   0.2576                                     
REMARK   3      T33:   0.5665 T12:  -0.1776                                     
REMARK   3      T13:  -0.1060 T23:   0.0817                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.6430 L22:   1.4401                                     
REMARK   3      L33:   3.8629 L12:  -1.0725                                     
REMARK   3      L13:  -1.2189 L23:  -1.2534                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.5033 S12:  -0.0941 S13:  -0.7882                       
REMARK   3      S21:   0.6681 S22:   0.0332 S23:   1.0300                       
REMARK   3      S31:   0.2875 S32:  -0.4511 S33:   0.3089                       
REMARK   3   TLS GROUP : 15                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 199:206)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  -2.3921 -21.3934 -12.3004              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4933 T22:   0.3223                                     
REMARK   3      T33:   0.2090 T12:  -0.0710                                     
REMARK   3      T13:  -0.0653 T23:  -0.0098                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.9419 L22:   6.8537                                     
REMARK   3      L33:   4.4639 L12:  -0.7605                                     
REMARK   3      L13:   2.5841 L23:   2.0339                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0755 S12:  -0.1295 S13:  -0.5801                       
REMARK   3      S21:  -0.4848 S22:  -0.0093 S23:   0.3552                       
REMARK   3      S31:   0.5468 S32:  -0.8834 S33:  -0.1420                       
REMARK   3   TLS GROUP : 16                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 207:217)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   0.5867 -28.9498  -6.0029              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.7048 T22:   0.2603                                     
REMARK   3      T33:   0.4047 T12:  -0.1355                                     
REMARK   3      T13:  -0.2577 T23:  -0.0532                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.3603 L22:   3.1998                                     
REMARK   3      L33:   2.5950 L12:  -0.6003                                     
REMARK   3      L13:  -2.4425 L23:   0.2245                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2142 S12:   0.3810 S13:  -0.6042                       
REMARK   3      S21:  -0.4000 S22:  -0.0283 S23:   0.4506                       
REMARK   3      S31:   0.8518 S32:  -0.5891 S33:   0.2013                       
REMARK   3   TLS GROUP : 17                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 35:40)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  20.9955 -21.8177  15.6612              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2610 T22:   0.2715                                     
REMARK   3      T33:   0.2843 T12:   0.0323                                     
REMARK   3      T13:   0.0129 T23:   0.0071                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.5812 L22:   3.7729                                     
REMARK   3      L33:   4.1790 L12:  -0.5405                                     
REMARK   3      L13:   0.4763 L23:   3.5344                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1018 S12:   0.4026 S13:  -0.3501                       
REMARK   3      S21:  -0.0177 S22:   0.1793 S23:  -0.5305                       
REMARK   3      S31:   0.1798 S32:   0.7544 S33:  -0.0120                       
REMARK   3   TLS GROUP : 18                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 41:49)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  12.3442 -18.6911  32.0796              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2434 T22:   0.1671                                     
REMARK   3      T33:   0.2100 T12:  -0.0101                                     
REMARK   3      T13:  -0.0128 T23:  -0.0015                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.4722 L22:   4.5408                                     
REMARK   3      L33:   4.6719 L12:  -0.9759                                     
REMARK   3      L13:  -1.0211 L23:  -0.0544                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2044 S12:  -0.0871 S13:  -0.2381                       
REMARK   3      S21:   0.3982 S22:   0.0567 S23:   0.0217                       
REMARK   3      S31:   0.6358 S32:  -0.4974 S33:   0.1116                       
REMARK   3   TLS GROUP : 19                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 50:55)                              
REMARK   3    ORIGIN FOR THE GROUP (A):   1.7942 -16.9878  47.4252              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6369 T22:   1.1789                                     
REMARK   3      T33:   0.6209 T12:   0.0998                                     
REMARK   3      T13:   0.2581 T23:   0.2154                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.7906 L22:   0.6805                                     
REMARK   3      L33:   5.2380 L12:   1.3025                                     
REMARK   3      L13:   2.5237 L23:   1.5934                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0091 S12:  -0.7200 S13:  -0.0683                       
REMARK   3      S21:   0.8091 S22:   0.2503 S23:   1.0397                       
REMARK   3      S31:  -0.5087 S32:  -2.0539 S33:  -0.1676                       
REMARK   3   TLS GROUP : 20                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 56:77)                              
REMARK   3    ORIGIN FOR THE GROUP (A):  11.1308 -20.8381  27.9992              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2204 T22:   0.1342                                     
REMARK   3      T33:   0.1925 T12:  -0.0181                                     
REMARK   3      T13:   0.0264 T23:   0.0262                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.3163 L22:   1.1246                                     
REMARK   3      L33:   4.6531 L12:   0.2282                                     
REMARK   3      L13:   0.8276 L23:   0.7804                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0855 S12:  -0.0929 S13:  -0.1232                       
REMARK   3      S21:   0.1796 S22:  -0.0435 S23:  -0.0342                       
REMARK   3      S31:   0.4869 S32:  -0.1117 S33:   0.0682                       
REMARK   3   TLS GROUP : 21                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 78:82)                              
REMARK   3    ORIGIN FOR THE GROUP (A):   1.2149 -19.4714  24.8705              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5883 T22:   0.3906                                     
REMARK   3      T33:   0.5297 T12:  -0.1539                                     
REMARK   3      T13:   0.0769 T23:  -0.1057                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.4138 L22:   3.2385                                     
REMARK   3      L33:   8.9794 L12:  -0.5707                                     
REMARK   3      L13:  -3.0162 L23:   2.6857                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1027 S12:  -0.2137 S13:  -0.5052                       
REMARK   3      S21:   0.6113 S22:  -0.3675 S23:   1.9462                       
REMARK   3      S31:   0.5069 S32:  -0.0745 S33:   0.7772                       
REMARK   3   TLS GROUP : 22                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 83:102)                             
REMARK   3    ORIGIN FOR THE GROUP (A):   9.2055 -14.5321  34.4644              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2806 T22:   0.1955                                     
REMARK   3      T33:   0.2570 T12:  -0.0510                                     
REMARK   3      T13:   0.0196 T23:   0.0219                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7527 L22:   4.2132                                     
REMARK   3      L33:   5.8584 L12:  -0.0349                                     
REMARK   3      L13:  -0.3434 L23:  -0.2553                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1113 S12:  -0.1218 S13:  -0.1570                       
REMARK   3      S21:   0.3969 S22:  -0.0957 S23:   0.4287                       
REMARK   3      S31:   0.2987 S32:  -0.4895 S33:   0.0453                       
REMARK   3   TLS GROUP : 23                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 103:107)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  21.6316 -11.5388  40.4811              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2869 T22:   0.2636                                     
REMARK   3      T33:   0.2655 T12:  -0.0261                                     
REMARK   3      T13:  -0.0381 T23:   0.0744                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.8446 L22:   2.4115                                     
REMARK   3      L33:   1.6073 L12:   0.1566                                     
REMARK   3      L13:  -1.8634 L23:   0.2324                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2741 S12:  -0.6194 S13:  -0.1446                       
REMARK   3      S21:  -0.5944 S22:   0.2894 S23:  -0.3715                       
REMARK   3      S31:   0.2200 S32:   0.1437 S33:   0.3284                       
REMARK   3   TLS GROUP : 24                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 108:125)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   4.9100  -2.9037  30.7696              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2753 T22:   0.3164                                     
REMARK   3      T33:   0.2735 T12:   0.0541                                     
REMARK   3      T13:   0.0654 T23:  -0.0149                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.7753 L22:   4.3097                                     
REMARK   3      L33:   4.3310 L12:   1.0474                                     
REMARK   3      L13:  -0.9270 L23:  -0.1924                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1869 S12:   0.0848 S13:   0.4656                       
REMARK   3      S21:   0.2338 S22:  -0.0194 S23:   0.5876                       
REMARK   3      S31:  -0.2666 S32:  -0.9561 S33:  -0.0816                       
REMARK   3   TLS GROUP : 25                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 126:142)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  10.8192  -8.7407  22.0108              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1890 T22:   0.1320                                     
REMARK   3      T33:   0.2011 T12:   0.0040                                     
REMARK   3      T13:   0.0035 T23:   0.0192                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.5250 L22:   2.1310                                     
REMARK   3      L33:   3.8321 L12:  -0.4680                                     
REMARK   3      L13:  -0.7351 L23:  -0.6520                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0934 S12:  -0.0174 S13:   0.1117                       
REMARK   3      S21:   0.0736 S22:   0.1144 S23:   0.1191                       
REMARK   3      S31:  -0.1635 S32:  -0.0872 S33:   0.0708                       
REMARK   3   TLS GROUP : 26                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 143:147)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  25.8795  -4.6355  23.3833              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3972 T22:   0.5232                                     
REMARK   3      T33:   0.4518 T12:  -0.0874                                     
REMARK   3      T13:   0.1150 T23:   0.0092                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.7727 L22:   5.8467                                     
REMARK   3      L33:   2.0024 L12:   4.5485                                     
REMARK   3      L13:  -4.3775 L23:  -3.9802                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.8563 S12:   1.4378 S13:  -0.3153                       
REMARK   3      S21:  -0.9207 S22:   0.2793 S23:  -1.3793                       
REMARK   3      S31:   1.1950 S32:   0.7237 S33:  -0.3972                       
REMARK   3   TLS GROUP : 27                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 148:170)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  10.8184  -6.3144  33.6101              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2350 T22:   0.1948                                     
REMARK   3      T33:   0.2139 T12:   0.0196                                     
REMARK   3      T13:   0.0154 T23:   0.0198                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9794 L22:   3.5835                                     
REMARK   3      L33:   3.4086 L12:   0.8840                                     
REMARK   3      L13:   0.7838 L23:   0.3233                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0150 S12:  -0.3225 S13:   0.2002                       
REMARK   3      S21:   0.3135 S22:  -0.0156 S23:   0.1412                       
REMARK   3      S31:  -0.1324 S32:  -0.3031 S33:  -0.0368                       
REMARK   3   TLS GROUP : 28                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 171:180)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  23.2553   2.7768  29.5150              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2960 T22:   0.2459                                     
REMARK   3      T33:   0.3247 T12:  -0.0796                                     
REMARK   3      T13:  -0.0317 T23:   0.0313                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.2262 L22:   4.7223                                     
REMARK   3      L33:   1.1971 L12:   1.5454                                     
REMARK   3      L13:  -1.5390 L23:  -2.2648                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3405 S12:   0.2658 S13:   0.7140                       
REMARK   3      S21:   0.3681 S22:  -0.1974 S23:  -0.4804                       
REMARK   3      S31:  -0.8630 S32:   0.9417 S33:  -0.4926                       
REMARK   3   TLS GROUP : 29                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 181:186)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  13.8548   1.4780  21.2850              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3271 T22:   0.1597                                     
REMARK   3      T33:   0.2306 T12:  -0.0235                                     
REMARK   3      T13:   0.0009 T23:   0.0080                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.9942 L22:   2.8082                                     
REMARK   3      L33:   6.1539 L12:  -2.4906                                     
REMARK   3      L13:   1.6056 L23:  -1.3885                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0564 S12:   0.3102 S13:   0.6151                       
REMARK   3      S21:  -0.9146 S22:   0.0384 S23:   0.0456                       
REMARK   3      S31:  -0.2349 S32:   0.3880 S33:   0.1416                       
REMARK   3   TLS GROUP : 30                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 187:197)                            
REMARK   3    ORIGIN FOR THE GROUP (A):   8.7009   5.4961  26.1780              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2934 T22:   0.1642                                     
REMARK   3      T33:   0.2370 T12:   0.0202                                     
REMARK   3      T13:   0.0014 T23:   0.0009                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.9857 L22:   4.9991                                     
REMARK   3      L33:   1.1449 L12:  -0.5044                                     
REMARK   3      L13:  -0.6192 L23:   1.9789                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0093 S12:  -0.0351 S13:   0.0160                       
REMARK   3      S21:  -0.3651 S22:  -0.2192 S23:   0.1926                       
REMARK   3      S31:  -0.1530 S32:  -0.3860 S33:  -0.1387                       
REMARK   3   TLS GROUP : 31                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 198:206)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  14.0128  -0.8112  43.6848              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4411 T22:   0.2742                                     
REMARK   3      T33:   0.2451 T12:  -0.0085                                     
REMARK   3      T13:  -0.0361 T23:  -0.0351                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.6667 L22:   7.5603                                     
REMARK   3      L33:   2.2887 L12:  -0.4347                                     
REMARK   3      L13:  -1.1874 L23:   0.4233                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1135 S12:  -0.4864 S13:   0.6157                       
REMARK   3      S21:   1.1592 S22:  -0.0253 S23:   0.2532                       
REMARK   3      S31:  -0.4898 S32:  -0.2613 S33:  -0.2519                       
REMARK   3   TLS GROUP : 32                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 207:217)                            
REMARK   3    ORIGIN FOR THE GROUP (A):  14.9175   6.2435  37.2059              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6823 T22:   0.2919                                     
REMARK   3      T33:   0.3023 T12:   0.0467                                     
REMARK   3      T13:  -0.0838 T23:  -0.0567                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.6165 L22:   0.3790                                     
REMARK   3      L33:   2.8621 L12:   1.0482                                     
REMARK   3      L13:   2.4774 L23:   0.9570                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3810 S12:  -0.8201 S13:   0.3892                       
REMARK   3      S21:   1.3292 S22:   0.0329 S23:  -0.1384                       
REMARK   3      S31:  -0.6425 S32:  -0.4876 S33:  -0.0346                       
REMARK   3   TLS GROUP : 33                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 301)                                
REMARK   3    ORIGIN FOR THE GROUP (A):  -6.6020 -13.5637  -8.1004              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4979 T22:   0.5875                                     
REMARK   3      T33:   0.3994 T12:   0.0491                                     
REMARK   3      T13:  -0.0381 T23:   0.0072                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.8074 L22:   0.1627                                     
REMARK   3      L33:   0.1975 L12:  -0.0494                                     
REMARK   3      L13:   0.3044 L23:   0.0987                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -1.2059 S12:  -0.5676 S13:  -0.0390                       
REMARK   3      S21:  -0.0962 S22:   0.6182 S23:   0.7498                       
REMARK   3      S31:   1.2266 S32:  -1.0394 S33:  -0.0120                       
REMARK   3   TLS GROUP : 34                                                     
REMARK   3    SELECTION: (CHAIN B AND RESID 1000)                               
REMARK   3    ORIGIN FOR THE GROUP (A):   7.3352  -8.2007  43.2362              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4787 T22:   0.4643                                     
REMARK   3      T33:   0.4875 T12:   0.0365                                     
REMARK   3      T13:   0.0899 T23:   0.0670                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.2033 L22:   0.4695                                     
REMARK   3      L33:   0.9806 L12:   0.2071                                     
REMARK   3      L13:  -0.0008 L23:   0.6484                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.8716 S12:  -0.1999 S13:   0.7011                       
REMARK   3      S21:   0.9062 S22:   0.8456 S23:   1.0568                       
REMARK   3      S31:  -1.4332 S32:  -0.7220 S33:  -0.0462                       
REMARK   3   TLS GROUP : 35                                                     
REMARK   3    SELECTION: (CHAIN A AND RESID 302)                                
REMARK   3    ORIGIN FOR THE GROUP (A):  -5.0880   2.5968   1.8250              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6109 T22:   0.4870                                     
REMARK   3      T33:   0.5872 T12:   0.0098                                     
REMARK   3      T13:  -0.0855 T23:   0.0141                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   8.5174 L22:   3.9961                                     
REMARK   3      L33:   3.1236 L12:   4.8442                                     
REMARK   3      L13:   1.7968 L23:   2.7836                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2858 S12:   0.2627 S13:  -0.7920                       
REMARK   3      S21:   0.8757 S22:  -0.0052 S23:   0.3830                       
REMARK   3      S31:   0.3882 S32:   1.3110 S33:  -0.1396                       
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 4TQC COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-JUN-14.                  
REMARK 100 THE DEPOSITION ID IS D_1000202060.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 15-MAY-12                          
REMARK 200  TEMPERATURE           (KELVIN) : 80                                 
REMARK 200  PH                             : 8.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : NULL                               
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : APS                                
REMARK 200  BEAMLINE                       : 24-ID-E                            
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.97921                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : ADSC QUANTUM 315                   
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : NULL                               
REMARK 200  DATA SCALING SOFTWARE          : NULL                               
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 32707                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.800                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 19.550                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 93.8                               
REMARK 200  DATA REDUNDANCY                : 3.270                              
REMARK 200  R MERGE                    (I) : NULL                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 24.7000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : NULL                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : NULL                               
REMARK 200  DATA REDUNDANCY IN SHELL       : NULL                               
REMARK 200  R MERGE FOR SHELL          (I) : NULL                               
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: NULL                         
REMARK 200 SOFTWARE USED: NULL                                                  
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 42.73                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.15                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 4000 12-20%, 100MM MES PH 8.5, 10%   
REMARK 280  IPN, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 290K                
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1                         
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,Y+1/2,-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   SMTRY1   2 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.000000  1.000000  0.000000       36.82000            
REMARK 290   SMTRY3   2  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1, 2                                                    
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 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     MET A    27                                                      
REMARK 465     VAL A    28                                                      
REMARK 465     ALA A    29                                                      
REMARK 465     ASN A    30                                                      
REMARK 465     PRO A    31                                                      
REMARK 465     GLU A    32                                                      
REMARK 465     HIS A    33                                                      
REMARK 465     TYR A    34                                                      
REMARK 465     SER A    83                                                      
REMARK 465     ASN A    84                                                      
REMARK 465     LEU A    85                                                      
REMARK 465     GLY A   208                                                      
REMARK 465     SER A   209                                                      
REMARK 465     THR A   210                                                      
REMARK 465     THR A   211                                                      
REMARK 465     MET B    27                                                      
REMARK 465     VAL B    28                                                      
REMARK 465     ALA B    29                                                      
REMARK 465     ASN B    30                                                      
REMARK 465     PRO B    31                                                      
REMARK 465     GLU B    32                                                      
REMARK 465     HIS B    33                                                      
REMARK 465     TYR B    34                                                      
REMARK 465     GLY B   208                                                      
REMARK 465     SER B   209                                                      
REMARK 465     THR B   210                                                      
REMARK 465     THR B   211                                                      
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT                     
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.                            
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE          
REMARK 500  HH11  ARG A   186     O    HOH A   493              1.40            
REMARK 500  HE21  GLN A   198     O    HOH A   540              1.53            
REMARK 500  HH21  ARG A   186     O    HOH A   568              1.54            
REMARK 500   H    LYS B   119     O    HOH B  1287              1.57            
REMARK 500   H    ALA A   158     O    HOH A   403              1.58            
REMARK 500   O    HOH A   449     O    HOH A   577              1.82            
REMARK 500   OE2  GLU B   171     O    HOH B  1282              1.84            
REMARK 500   O    HOH A   431     O    HOH A   509              1.88            
REMARK 500   NH2  ARG A   186     O    HOH A   568              1.93            
REMARK 500   O    HOH B  1135     O    HOH B  1154              1.96            
REMARK 500   OE1  GLU A   185     O    HOH A   558              2.00            
REMARK 500   O    HOH B  1150     O    HOH B  1157              2.02            
REMARK 500   O    HOH A   538     O    HOH A   562              2.03            
REMARK 500   O    HOH B  1138     O    HOH B  1144              2.05            
REMARK 500   O    HOH B  1272     O    HOH B  1284              2.05            
REMARK 500   O    HOH B  1239     O    HOH B  1300              2.05            
REMARK 500   O    HOH B  1257     O    HOH B  1265              2.06            
REMARK 500   O    HOH B  1281     O    HOH B  1318              2.08            
REMARK 500   O    HOH B  1273     O    HOH B  1274              2.09            
REMARK 500   OG   SER B    64     O    HOH B  1194              2.10            
REMARK 500   O    HOH A   445     O    HOH A   448              2.11            
REMARK 500   O    HOH A   523     O    HOH A   526              2.12            
REMARK 500   O    HOH B  1252     O    HOH B  1253              2.13            
REMARK 500   OE2  GLU A   185     O    HOH A   537              2.14            
REMARK 500   O    HOH A   505     O    HOH A   506              2.15            
REMARK 500   O    HOH A   438     O    HOH A   515              2.16            
REMARK 500   N    LYS A   212     O    HOH A   536              2.18            
REMARK 500   O    HOH B  1278     O    HOH B  1323              2.18            
REMARK 500   OE1  GLU A   105     O    HOH A   401              2.19            
REMARK 500   NH1  ARG A   186     O    HOH A   493              2.19            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS                                             
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC             
REMARK 500 SYMMETRY ARE IN CLOSE CONTACT.  AN ATOM LOCATED WITHIN 0.15          
REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A           
REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375             
REMARK 500 INSTEAD OF REMARK 500.  ATOMS WITH NON-BLANK ALTERNATE               
REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS.            
REMARK 500                                                                      
REMARK 500 DISTANCE CUTOFF:                                                     
REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS              
REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS                  
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI  SSYMOP   DISTANCE          
REMARK 500   O    HOH A   447     O    HOH A   539     2655     1.95            
REMARK 500   O    HOH A   428     O    HOH B  1141     1554     2.10            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
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       22.86   -145.35                                   
REMARK 500    ASP A 143     -129.69     52.66                                   
REMARK 500    ASP B  67       22.36   -148.37                                   
REMARK 500    ASP B 143     -119.86     51.52                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 525                                                                      
REMARK 525 SOLVENT                                                              
REMARK 525                                                                      
REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT                    
REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST                  
REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT                 
REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE                       
REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER;                             
REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE                  
REMARK 525 NUMBER; I=INSERTION CODE):                                           
REMARK 525                                                                      
REMARK 525  M RES CSSEQI                                                        
REMARK 525    HOH A 550        DISTANCE =  7.37 ANGSTROMS                       
REMARK 525    HOH A 559        DISTANCE =  7.24 ANGSTROMS                       
REMARK 525    HOH A 561        DISTANCE =  7.13 ANGSTROMS                       
REMARK 525    HOH B1237        DISTANCE =  6.00 ANGSTROMS                       
REMARK 525    HOH B1255        DISTANCE =  6.60 ANGSTROMS                       
REMARK 525    HOH B1273        DISTANCE =  6.42 ANGSTROMS                       
REMARK 525    HOH B1291        DISTANCE =  6.25 ANGSTROMS                       
REMARK 525    HOH B1292        DISTANCE =  6.71 ANGSTROMS                       
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue M7G A 301                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue 34J A 302                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue M7G B 1000                
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 4TPW   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 4TQB   RELATED DB: PDB                                   
DBREF  4TQC A   28   217  UNP    P06730   IF4E_HUMAN      28    217             
DBREF  4TQC B   28   217  UNP    P06730   IF4E_HUMAN      28    217             
SEQADV 4TQC MET A   27  UNP  P06730              INITIATING METHIONINE          
SEQADV 4TQC MET B   27  UNP  P06730              INITIATING METHIONINE          
SEQRES   1 A  191  MET VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU          
SEQRES   2 A  191  GLN ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS          
SEQRES   3 A  191  SER LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS          
SEQRES   4 A  191  PHE ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS          
SEQRES   5 A  191  ILE GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR          
SEQRES   6 A  191  SER LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP          
SEQRES   7 A  191  GLU LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU          
SEQRES   8 A  191  ASN LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP          
SEQRES   9 A  191  LEU GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP          
SEQRES  10 A  191  ASP TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL          
SEQRES  11 A  191  ARG ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU          
SEQRES  12 A  191  CYS GLU ASN ARG GLU ALA VAL THR HIS ILE GLY ARG VAL          
SEQRES  13 A  191  TYR LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE          
SEQRES  14 A  191  GLY TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY          
SEQRES  15 A  191  SER THR THR LYS ASN ARG PHE VAL VAL                          
SEQRES   1 B  191  MET VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU          
SEQRES   2 B  191  GLN ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS          
SEQRES   3 B  191  SER LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS          
SEQRES   4 B  191  PHE ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS          
SEQRES   5 B  191  ILE GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR          
SEQRES   6 B  191  SER LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP          
SEQRES   7 B  191  GLU LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU          
SEQRES   8 B  191  ASN LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP          
SEQRES   9 B  191  LEU GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP          
SEQRES  10 B  191  ASP TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL          
SEQRES  11 B  191  ARG ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU          
SEQRES  12 B  191  CYS GLU ASN ARG GLU ALA VAL THR HIS ILE GLY ARG VAL          
SEQRES  13 B  191  TYR LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE          
SEQRES  14 B  191  GLY TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY          
SEQRES  15 B  191  SER THR THR LYS ASN ARG PHE VAL VAL                          
HET    M7G  A 301      43                                                       
HET    34J  A 302      42                                                       
HET    M7G  B1000      43                                                       
HETNAM     M7G 7N-METHYL-8-HYDROGUANOSINE-5'-DIPHOSPHATE                        
HETNAM     34J (2S)-3-(4-AMINO-3-NITROPHENYL)-2-{2-[4-(3,4-                     
HETNAM   2 34J  DICHLOROPHENYL)-1,3-THIAZOL-2-YL]HYDRAZINYL}PROPANOIC           
HETNAM   3 34J  ACID                                                            
FORMUL   3  M7G    2(C11 H19 N5 O11 P2)                                         
FORMUL   4  34J    C18 H15 CL2 N5 O4 S                                          
FORMUL   6  HOH   *410(H2 O)                                                    
HELIX    1 AA1 THR A   55  ALA A   58  5                                   4    
HELIX    2 AA2 VAL A   69  SER A   82  1                                  14    
HELIX    3 AA3 GLN A  120  ASP A  125  1                                   6    
HELIX    4 AA4 ASP A  125  GLY A  139  1                                  15    
HELIX    5 AA5 PHE A  142  ASP A  147  5                                   6    
HELIX    6 AA6 ASN A  172  LEU A  187  1                                  16    
HELIX    7 AA7 HIS A  200  ALA A  204  1                                   5    
HELIX    8 AA8 THR B   55  ALA B   58  5                                   4    
HELIX    9 AA9 VAL B   69  ASN B   77  1                                   9    
HELIX   10 AB1 LEU B   81  LEU B   85  5                                   5    
HELIX   11 AB2 GLN B  120  ASP B  125  1                                   6    
HELIX   12 AB3 ASP B  125  GLY B  139  1                                  15    
HELIX   13 AB4 PHE B  142  ASP B  147  5                                   6    
HELIX   14 AB5 ASN B  172  LEU B  187  1                                  16    
HELIX   15 AB6 HIS B  200  THR B  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  TRP A  43   O  PHE A  66           
SHEET    3 AA1 8 ASP A  90  LYS A  95 -1  O  SER A  92   N  TRP A  46           
SHEET    4 AA1 8 VAL A 149  ASN A 155 -1  O  VAL A 154   N  TYR A  91           
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  GLY A 196   N  LEU A 114           
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  SER B  64           
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  VAL B 154   N  TYR B  91           
SHEET    5 AA2 8 LYS B 162  THR B 167 -1  O  LYS B 162   N  ASN B 155           
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           
SITE     1 AC1 11 TRP A  56  MET A 101  TRP A 102  GLU A 103                    
SITE     2 AC1 11 ARG A 157  LYS A 162  HOH A 425  HOH A 470                    
SITE     3 AC1 11 HOH A 508  HOH A 573  THR B  55                               
SITE     1 AC2  7 PHE A  47  LYS A  49  ASN A  59  ARG A  61                    
SITE     2 AC2  7 HIS A  78  SER A  82  HOH A 427                               
SITE     1 AC3 12 THR A  55  TRP B  56  MET B 101  TRP B 102                    
SITE     2 AC3 12 GLU B 103  ARG B 157  LYS B 162  HOH B1126                    
SITE     3 AC3 12 HOH B1169  HOH B1185  HOH B1259  HOH B1300                    
CRYST1   40.210   73.640   66.980  90.00  74.92  90.00 P 1 21 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      0.024869  0.000000 -0.006701        0.00000                         
SCALE2      0.000000  0.013580  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.015462        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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