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Database: PDB
Entry: 5L0R
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HEADER    TRANSFERASE                             28-JUL-16   5L0R              
TITLE     HUMAN POGLUT1 IN COMPLEX WITH NOTCH1 EGF12 AND UDP                    
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: PROTEIN O-GLUCOSYLTRANSFERASE 1;                           
COMPND   3 CHAIN: A;                                                            
COMPND   4 SYNONYM: CAP10-LIKE 46 KDA PROTEIN,HCLP46,KTEL MOTIF-CONTAINING      
COMPND   5 PROTEIN 1,MYELODYSPLASTIC SYNDROMES RELATIVE PROTEIN,O-              
COMPND   6 GLUCOSYLTRANSFERASE RUMI HOMOLOG,HRUMI,PROTEIN O-XYLOSYLTRANSFERASE; 
COMPND   7 EC: 2.4.1.-,2.4.2.26;                                                
COMPND   8 ENGINEERED: YES;                                                     
COMPND   9 MOL_ID: 2;                                                           
COMPND  10 MOLECULE: NEUROGENIC LOCUS NOTCH HOMOLOG PROTEIN 1;                  
COMPND  11 CHAIN: B;                                                            
COMPND  12 SYNONYM: HN1,TRANSLOCATION-ASSOCIATED NOTCH PROTEIN TAN-1;           
COMPND  13 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: POGLUT1, C3ORF9, CLP46, KTELC1, MDSRP, MDS010, UNQ490/PRO1006; 
SOURCE   6 EXPRESSION_SYSTEM: HOMO SAPIENS;                                     
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 9606;                                       
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: HEK293S GNTI-;                             
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PB-T-PAF;                                 
SOURCE  11 MOL_ID: 2;                                                           
SOURCE  12 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE  13 ORGANISM_COMMON: HUMAN;                                              
SOURCE  14 ORGANISM_TAXID: 9606;                                                
SOURCE  15 GENE: NOTCH1, TAN1;                                                  
SOURCE  16 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE  17 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE  18 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
SOURCE  19 EXPRESSION_SYSTEM_PLASMID: PMAL                                      
KEYWDS    TRANSFERASE GLYCOSYLTRANSFERASE GT-B GLUCOSYLTRANSFERASE, TRANSFERASE 
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    Z.LI,J.M.RINI                                                         
REVDAT   2   30-AUG-17 5L0R    1       JRNL                                     
REVDAT   1   09-AUG-17 5L0R    0                                                
JRNL        AUTH   Z.LI,M.FISCHER,M.SATKUNARAJAH,D.ZHOU,S.G.WITHERS,J.M.RINI    
JRNL        TITL   STRUCTURAL BASIS OF NOTCH O-GLUCOSYLATION AND O-XYLOSYLATION 
JRNL        TITL 2 BY MAMMALIAN PROTEIN-O-GLUCOSYLTRANSFERASE 1 (POGLUT1).      
JRNL        REF    NAT COMMUN                    V.   8   185 2017              
JRNL        REFN                   ESSN 2041-1723                               
JRNL        PMID   28775322                                                     
JRNL        DOI    10.1038/S41467-017-00255-7                                   
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.50 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX 1.10.1_2155                                   
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 : NULL                                          
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 1.50                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 43.45                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.350                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 98.3                           
REMARK   3   NUMBER OF REFLECTIONS             : 68829                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.150                           
REMARK   3   R VALUE            (WORKING SET) : 0.149                           
REMARK   3   FREE R VALUE                     : 0.171                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.000                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 3442                            
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 43.4664 -  4.3846    0.96     2742   145  0.1568 0.1702        
REMARK   3     2  4.3846 -  3.4807    0.97     2660   140  0.1237 0.1537        
REMARK   3     3  3.4807 -  3.0408    0.97     2646   139  0.1363 0.1413        
REMARK   3     4  3.0408 -  2.7628    0.98     2652   139  0.1397 0.1822        
REMARK   3     5  2.7628 -  2.5648    0.99     2643   140  0.1390 0.1734        
REMARK   3     6  2.5648 -  2.4136    0.99     2642   139  0.1337 0.1516        
REMARK   3     7  2.4136 -  2.2928    0.99     2658   140  0.1275 0.1440        
REMARK   3     8  2.2928 -  2.1930    0.99     2606   137  0.1317 0.1658        
REMARK   3     9  2.1930 -  2.1085    1.00     2679   141  0.1318 0.1565        
REMARK   3    10  2.1085 -  2.0358    1.00     2618   138  0.1366 0.1352        
REMARK   3    11  2.0358 -  1.9721    1.00     2648   139  0.1376 0.1625        
REMARK   3    12  1.9721 -  1.9158    1.00     2628   138  0.1407 0.1888        
REMARK   3    13  1.9158 -  1.8653    1.00     2649   140  0.1414 0.1647        
REMARK   3    14  1.8653 -  1.8198    1.00     2619   138  0.1515 0.1836        
REMARK   3    15  1.8198 -  1.7784    1.00     2644   139  0.1588 0.1702        
REMARK   3    16  1.7784 -  1.7406    1.00     2641   138  0.1684 0.2090        
REMARK   3    17  1.7406 -  1.7058    1.00     2614   138  0.1724 0.1854        
REMARK   3    18  1.7058 -  1.6736    1.00     2641   139  0.1886 0.1986        
REMARK   3    19  1.6736 -  1.6437    1.00     2617   137  0.1968 0.1841        
REMARK   3    20  1.6437 -  1.6158    1.00     2660   141  0.2068 0.2193        
REMARK   3    21  1.6158 -  1.5898    1.00     2623   138  0.2181 0.2442        
REMARK   3    22  1.5898 -  1.5653    1.00     2599   137  0.2373 0.2559        
REMARK   3    23  1.5653 -  1.5423    0.99     2594   136  0.2553 0.3038        
REMARK   3    24  1.5423 -  1.5206    0.91     2416   128  0.2804 0.2871        
REMARK   3    25  1.5206 -  1.5000    0.86     2248   118  0.3045 0.2709        
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED        : NULL                                          
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)     : 0.140            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 16.700           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 17.50                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 32.52                          
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      :  0.013           3467                                  
REMARK   3   ANGLE     :  1.299           4716                                  
REMARK   3   CHIRALITY :  0.072            488                                  
REMARK   3   PLANARITY :  0.010            601                                  
REMARK   3   DIHEDRAL  : 14.893           2080                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 13                                         
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 30 THROUGH 68 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):   3.5857  29.7995  34.6921              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1923 T22:   0.4228                                     
REMARK   3      T33:   0.1578 T12:  -0.0238                                     
REMARK   3      T13:   0.0224 T23:  -0.0023                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.6322 L22:   0.9968                                     
REMARK   3      L33:   1.7436 L12:  -0.9227                                     
REMARK   3      L13:   0.7210 L23:  -0.2762                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1191 S12:  -0.3554 S13:   0.0200                       
REMARK   3      S21:   0.0886 S22:   0.1457 S23:   0.1729                       
REMARK   3      S31:   0.0628 S32:  -0.6882 S33:  -0.0502                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 69 THROUGH 104 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):  32.1854  12.6432  31.9730              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2601 T22:   0.3141                                     
REMARK   3      T33:   0.2587 T12:   0.1290                                     
REMARK   3      T13:  -0.0593 T23:  -0.0089                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.1412 L22:   2.9602                                     
REMARK   3      L33:   4.2746 L12:  -0.6658                                     
REMARK   3      L13:  -0.3529 L23:  -0.8019                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0006 S12:  -0.2222 S13:  -0.2451                       
REMARK   3      S21:  -0.0102 S22:  -0.0418 S23:  -0.1352                       
REMARK   3      S31:   0.5580 S32:   0.5148 S33:   0.0206                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 105 THROUGH 176 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  23.7597  19.7490  26.6580              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1511 T22:   0.1351                                     
REMARK   3      T33:   0.1424 T12:   0.0299                                     
REMARK   3      T13:  -0.0226 T23:  -0.0149                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7689 L22:   1.5173                                     
REMARK   3      L33:   3.3439 L12:  -0.5971                                     
REMARK   3      L13:   0.2772 L23:  -0.7014                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0377 S12:  -0.1566 S13:  -0.1511                       
REMARK   3      S21:   0.0740 S22:   0.0978 S23:  -0.0248                       
REMARK   3      S31:   0.2667 S32:   0.1864 S33:  -0.0809                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 177 THROUGH 197 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  19.8180  38.8103  16.0966              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2319 T22:   0.1087                                     
REMARK   3      T33:   0.2128 T12:  -0.0359                                     
REMARK   3      T13:   0.0145 T23:   0.0127                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.1272 L22:   1.0521                                     
REMARK   3      L33:   1.3376 L12:  -1.2184                                     
REMARK   3      L13:  -0.2418 L23:   0.7197                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0325 S12:   0.1602 S13:   0.4674                       
REMARK   3      S21:  -0.1660 S22:   0.0611 S23:  -0.1042                       
REMARK   3      S31:  -0.4290 S32:   0.1191 S33:  -0.0234                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 198 THROUGH 227 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   3.3189  29.7341   8.8107              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1206 T22:   0.1890                                     
REMARK   3      T33:   0.1058 T12:   0.0060                                     
REMARK   3      T13:   0.0082 T23:   0.0158                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.0603 L22:   2.4746                                     
REMARK   3      L33:   2.7866 L12:   0.1694                                     
REMARK   3      L13:   0.5027 L23:   1.1957                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1103 S12:   0.2915 S13:   0.0245                       
REMARK   3      S21:  -0.0332 S22:  -0.1363 S23:   0.1945                       
REMARK   3      S31:  -0.0770 S32:  -0.3081 S33:   0.0095                       
REMARK   3   TLS GROUP : 6                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 228 THROUGH 248 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   8.7926  22.0780   2.6479              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1641 T22:   0.2532                                     
REMARK   3      T33:   0.1295 T12:   0.0082                                     
REMARK   3      T13:  -0.0290 T23:  -0.0572                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.1798 L22:   0.5798                                     
REMARK   3      L33:   2.6978 L12:   1.0965                                     
REMARK   3      L13:  -0.0908 L23:   0.8309                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1906 S12:   0.8387 S13:  -0.4308                       
REMARK   3      S21:  -0.1122 S22:  -0.0926 S23:  -0.0178                       
REMARK   3      S31:   0.1197 S32:  -0.0999 S33:  -0.1013                       
REMARK   3   TLS GROUP : 7                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 249 THROUGH 311 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   8.2189  29.3643  17.4971              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1217 T22:   0.1076                                     
REMARK   3      T33:   0.1231 T12:   0.0038                                     
REMARK   3      T13:  -0.0039 T23:   0.0031                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7601 L22:   0.8381                                     
REMARK   3      L33:   2.6174 L12:  -0.0857                                     
REMARK   3      L13:  -0.0289 L23:   0.1217                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0390 S12:   0.0408 S13:   0.0196                       
REMARK   3      S21:   0.0012 S22:   0.0228 S23:   0.0291                       
REMARK   3      S31:  -0.0553 S32:  -0.1597 S33:  -0.0658                       
REMARK   3   TLS GROUP : 8                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 312 THROUGH 331 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  -6.4728  28.2580  16.8414              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1267 T22:   0.2801                                     
REMARK   3      T33:   0.1672 T12:  -0.0120                                     
REMARK   3      T13:   0.0088 T23:   0.0062                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.7809 L22:   7.8450                                     
REMARK   3      L33:   4.1718 L12:  -1.6726                                     
REMARK   3      L13:   0.1185 L23:   1.0769                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0278 S12:   0.3092 S13:  -0.1192                       
REMARK   3      S21:   0.0182 S22:  -0.0685 S23:   0.4112                       
REMARK   3      S31:   0.0506 S32:  -0.6012 S33:   0.0322                       
REMARK   3   TLS GROUP : 9                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 332 THROUGH 349 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):   4.1118  40.4215  25.5226              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2402 T22:   0.1735                                     
REMARK   3      T33:   0.2281 T12:   0.0623                                     
REMARK   3      T13:   0.0352 T23:  -0.0222                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.5025 L22:   2.6455                                     
REMARK   3      L33:   7.0694 L12:  -1.2786                                     
REMARK   3      L13:   6.0812 L23:  -1.2032                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2318 S12:  -0.4404 S13:   0.7275                       
REMARK   3      S21:   0.2548 S22:   0.0908 S23:   0.1753                       
REMARK   3      S31:  -0.4529 S32:  -0.4757 S33:   0.1960                       
REMARK   3   TLS GROUP : 10                                                     
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 350 THROUGH 385 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  30.3067  22.7383  35.2708              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1997 T22:   0.3209                                     
REMARK   3      T33:   0.1755 T12:   0.0351                                     
REMARK   3      T13:  -0.0480 T23:  -0.0366                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.4555 L22:   2.6553                                     
REMARK   3      L33:   2.3621 L12:  -1.5942                                     
REMARK   3      L13:   0.5207 L23:  -0.9147                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1081 S12:  -0.3908 S13:  -0.0485                       
REMARK   3      S21:   0.2495 S22:   0.1054 S23:  -0.2638                       
REMARK   3      S31:   0.0714 S32:   0.4499 S33:   0.0496                       
REMARK   3   TLS GROUP : 11                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 452 THROUGH 470 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  24.9320  17.2574   7.9705              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2394 T22:   0.1722                                     
REMARK   3      T33:   0.1642 T12:   0.0422                                     
REMARK   3      T13:  -0.0156 T23:  -0.0314                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   9.2712 L22:   5.6502                                     
REMARK   3      L33:   6.6112 L12:   1.2831                                     
REMARK   3      L13:  -1.9687 L23:   2.3356                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0276 S12:  -0.0130 S13:  -0.6199                       
REMARK   3      S21:   0.2361 S22:  -0.0528 S23:   0.0818                       
REMARK   3      S31:   0.7215 S32:   0.1624 S33:   0.1484                       
REMARK   3   TLS GROUP : 12                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 471 THROUGH 477 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  29.4751  12.1114   8.9572              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5935 T22:   0.2497                                     
REMARK   3      T33:   0.4333 T12:   0.0778                                     
REMARK   3      T13:   0.0217 T23:  -0.0229                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.6712 L22:   3.6855                                     
REMARK   3      L33:   2.4337 L12:   1.7044                                     
REMARK   3      L13:   3.6107 L23:   2.3545                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0491 S12:  -0.1759 S13:  -1.5916                       
REMARK   3      S21:   0.6574 S22:   0.0246 S23:  -0.8192                       
REMARK   3      S31:   1.8516 S32:   0.0921 S33:   0.3018                       
REMARK   3   TLS GROUP : 13                                                     
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 478 THROUGH 491 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  36.0162  24.0250   5.3921              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2352 T22:   0.3800                                     
REMARK   3      T33:   0.2756 T12:  -0.0207                                     
REMARK   3      T13:   0.0417 T23:  -0.0693                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   7.0509 L22:   5.9648                                     
REMARK   3      L33:   1.9992 L12:  -1.4967                                     
REMARK   3      L13:  -1.7936 L23:   1.6273                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2438 S12:   0.0461 S13:   0.4785                       
REMARK   3      S21:  -0.2613 S22:   0.4209 S23:  -0.4611                       
REMARK   3      S31:  -0.2512 S32:   1.1300 S33:  -0.6059                       
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 5L0R COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-JUL-16.                  
REMARK 100 THE DEPOSITION ID IS D_1000223028.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 01-SEP-15                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : CLSI                               
REMARK 200  BEAMLINE                       : 08ID-1                             
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.97949                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : RAYONIX MX-300                     
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : XSCALE                             
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 68848                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.500                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 50.000                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 98.0                               
REMARK 200  DATA REDUNDANCY                : 5.700                              
REMARK 200  R MERGE                    (I) : 0.05300                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 19.1900                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.50                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.55                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 91.0                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 4.70                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.86400                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 1.640                              
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL                         
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 47.14                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.33                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 20% PEG5000 MME, 50 MM MES PH 6.5, 2MM   
REMARK 280  CACL2, 250MM NACL, 5% GLYCEROL, VAPOR DIFFUSION, HANGING DROP,      
REMARK 280  TEMPERATURE 295K                                                    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21                       
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X+1/2,-Y,Z+1/2                                         
REMARK 290       3555   -X,Y+1/2,-Z+1/2                                         
REMARK 290       4555   X+1/2,-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       35.29000            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       41.64000            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       36.78000            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       41.64000            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       35.29000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       36.78000            
REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
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: DIMERIC                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 3390 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 17870 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -36.0 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, 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     GLY A    29                                                      
REMARK 465     GLY B   450                                                      
REMARK 465     SER B   451                                                      
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     SER A  30    N    CA   CB   OG                                   
REMARK 470     LYS A  75    CG   CD   CE   NZ                                   
REMARK 470     ASP B 452    N    CA   CB   CG   OD1  OD2                        
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  HE21  GLN A   351     O    HOH A   502              1.43            
REMARK 500   H    GLY A   379     O    HOH A   504              1.55            
REMARK 500   H    GLY B   472     O    HOH B  3101              1.58            
REMARK 500   O    HOH A   510     O    HOH A   762              1.99            
REMARK 500   O    HOH A   510     O    HOH A   756              2.00            
REMARK 500   O    HOH A   516     O    HOH A   705              2.06            
REMARK 500   O    HOH A   765     O    HOH A   799              2.14            
REMARK 500   O    HOH B  3123     O    HOH B  3139              2.18            
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   582     O    HOH A   613     2564     2.09            
REMARK 500   O    HOH A   722     O    HOH A   766     2565     2.09            
REMARK 500   O    HOH A   643     O    HOH A   729     2564     2.13            
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    ARG A 183       69.37     39.51                                   
REMARK 500    ALA A 275     -142.02   -128.35                                   
REMARK 500    ASP A 295       26.15   -143.08                                   
REMARK 500    TRP A 308      -20.44     73.65                                   
REMARK 500    ILE B 471      101.10    -59.81                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 620                                                                      
REMARK 620 METAL COORDINATION                                                   
REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                             
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              CA B3001  CA                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 GLU B 455   OE2                                                    
REMARK 620 2 ASP B 469   OD1 149.7                                              
REMARK 620 3 GLU B 473   O    85.8  74.7                                        
REMARK 620 N                    1     2                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue UDP A 403                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue GOL A 404                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 405                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue CA B 3001                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for Mono-Saccharide NAG A 401 bound   
REMARK 800  to ASN A 53                                                         
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for Mono-Saccharide NAG A 402 bound   
REMARK 800  to ASN A 204                                                        
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 5L0S   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5L0T   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5L0U   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5L0V   RELATED DB: PDB                                   
DBREF  5L0R A   29   385  UNP    Q8NBL1   PGLT1_HUMAN     29    385             
DBREF  5L0R B  452   491  UNP    P46531   NOTC1_HUMAN    452    491             
SEQADV 5L0R GLY B  450  UNP  P46531              EXPRESSION TAG                 
SEQADV 5L0R SER B  451  UNP  P46531              EXPRESSION TAG                 
SEQRES   1 A  357  GLY SER LYS TRP LYS VAL PHE ILE ASP GLN ILE ASN ARG          
SEQRES   2 A  357  SER LEU GLU ASN TYR GLU PRO CYS SER SER GLN ASN CYS          
SEQRES   3 A  357  SER CYS TYR HIS GLY VAL ILE GLU GLU ASP LEU THR PRO          
SEQRES   4 A  357  PHE ARG GLY GLY ILE SER ARG LYS MET MET ALA GLU VAL          
SEQRES   5 A  357  VAL ARG ARG LYS LEU GLY THR HIS TYR GLN ILE THR LYS          
SEQRES   6 A  357  ASN ARG LEU TYR ARG GLU ASN ASP CYS MET PHE PRO SER          
SEQRES   7 A  357  ARG CYS SER GLY VAL GLU HIS PHE ILE LEU GLU VAL ILE          
SEQRES   8 A  357  GLY ARG LEU PRO ASP MET GLU MET VAL ILE ASN VAL ARG          
SEQRES   9 A  357  ASP TYR PRO GLN VAL PRO LYS TRP MET GLU PRO ALA ILE          
SEQRES  10 A  357  PRO VAL PHE SER PHE SER LYS THR SER GLU TYR HIS ASP          
SEQRES  11 A  357  ILE MET TYR PRO ALA TRP THR PHE TRP GLU GLY GLY PRO          
SEQRES  12 A  357  ALA VAL TRP PRO ILE TYR PRO THR GLY LEU GLY ARG TRP          
SEQRES  13 A  357  ASP LEU PHE ARG GLU ASP LEU VAL ARG SER ALA ALA GLN          
SEQRES  14 A  357  TRP PRO TRP LYS LYS LYS ASN SER THR ALA TYR PHE ARG          
SEQRES  15 A  357  GLY SER ARG THR SER PRO GLU ARG ASP PRO LEU ILE LEU          
SEQRES  16 A  357  LEU SER ARG LYS ASN PRO LYS LEU VAL ASP ALA GLU TYR          
SEQRES  17 A  357  THR LYS ASN GLN ALA TRP LYS SER MET LYS ASP THR LEU          
SEQRES  18 A  357  GLY LYS PRO ALA ALA LYS ASP VAL HIS LEU VAL ASP HIS          
SEQRES  19 A  357  CYS LYS TYR LYS TYR LEU PHE ASN PHE ARG GLY VAL ALA          
SEQRES  20 A  357  ALA SER PHE ARG PHE LYS HIS LEU PHE LEU CYS GLY SER          
SEQRES  21 A  357  LEU VAL PHE HIS VAL GLY ASP GLU TRP LEU GLU PHE PHE          
SEQRES  22 A  357  TYR PRO GLN LEU LYS PRO TRP VAL HIS TYR ILE PRO VAL          
SEQRES  23 A  357  LYS THR ASP LEU SER ASN VAL GLN GLU LEU LEU GLN PHE          
SEQRES  24 A  357  VAL LYS ALA ASN ASP ASP VAL ALA GLN GLU ILE ALA GLU          
SEQRES  25 A  357  ARG GLY SER GLN PHE ILE ARG ASN HIS LEU GLN MET ASP          
SEQRES  26 A  357  ASP ILE THR CYS TYR TRP GLU ASN LEU LEU SER GLU TYR          
SEQRES  27 A  357  SER LYS PHE LEU SER TYR ASN VAL THR ARG ARG LYS GLY          
SEQRES  28 A  357  TYR ASP GLN ILE ILE PRO                                      
SEQRES   1 B   42  GLY SER ASP VAL ASN GLU CYS VAL SER ASN PRO CYS GLN          
SEQRES   2 B   42  ASN ASP ALA THR CYS LEU ASP GLN ILE GLY GLU PHE GLN          
SEQRES   3 B   42  CYS ILE CYS MET PRO GLY TYR GLU GLY VAL HIS CYS GLU          
SEQRES   4 B   42  VAL ASN THR                                                  
HET    NAG  A 401      28                                                       
HET    NAG  A 402      28                                                       
HET    UDP  A 403      25                                                       
HET    GOL  A 404       6                                                       
HET     CL  A 405       1                                                       
HET     CA  B3001       1                                                       
HETNAM     NAG N-ACETYL-D-GLUCOSAMINE                                           
HETNAM     UDP URIDINE-5'-DIPHOSPHATE                                           
HETNAM     GOL GLYCEROL                                                         
HETNAM      CL CHLORIDE ION                                                     
HETNAM      CA CALCIUM ION                                                      
HETSYN     GOL GLYCERIN; PROPANE-1,2,3-TRIOL                                    
FORMUL   3  NAG    2(C8 H15 N O6)                                               
FORMUL   5  UDP    C9 H14 N2 O12 P2                                             
FORMUL   6  GOL    C3 H8 O3                                                     
FORMUL   7   CL    CL 1-                                                        
FORMUL   8   CA    CA 2+                                                        
FORMUL   9  HOH   *351(H2 O)                                                    
HELIX    1 AA1 TRP A   32  TYR A   46  1                                  15    
HELIX    2 AA2 ASN A   53  CYS A   56  5                                   4    
HELIX    3 AA3 TYR A   57  THR A   66  1                                  10    
HELIX    4 AA4 PRO A   67  ARG A   69  5                                   3    
HELIX    5 AA5 SER A   73  ARG A   83  1                                  11    
HELIX    6 AA6 PHE A  104  ILE A  119  1                                  16    
HELIX    7 AA7 GLY A  120  LEU A  122  5                                   3    
HELIX    8 AA8 ALA A  163  TRP A  167  5                                   5    
HELIX    9 AA9 ARG A  183  TRP A  198  1                                  16    
HELIX   10 AB1 PRO A  199  LYS A  203  5                                   5    
HELIX   11 AB2 SER A  215  GLU A  217  5                                   3    
HELIX   12 AB3 ARG A  218  ASN A  228  1                                  11    
HELIX   13 AB4 SER A  244  LEU A  249  5                                   6    
HELIX   14 AB5 HIS A  258  CYS A  263  5                                   6    
HELIX   15 AB6 PHE A  278  CYS A  286  1                                   9    
HELIX   16 AB7 PHE A  301  LEU A  305  5                                   5    
HELIX   17 AB8 ASN A  320  ASN A  331  1                                  12    
HELIX   18 AB9 ASN A  331  LEU A  350  1                                  20    
HELIX   19 AC1 GLN A  351  LYS A  368  1                                  18    
HELIX   20 AC2 ASN B  454  ASN B  459  5                                   6    
SHEET    1 AA1 4 MET A 125  ILE A 129  0                                        
SHEET    2 AA1 4 THR A  87  THR A  92 -1  N  TYR A  89   O  MET A 127           
SHEET    3 AA1 4 ARG A  95  ARG A  98 -1  O  TYR A  97   N  GLN A  90           
SHEET    4 AA1 4 ASP A 381  ILE A 383 -1  O  ILE A 383   N  LEU A  96           
SHEET    1 AA2 2 PHE A 148  SER A 149  0                                        
SHEET    2 AA2 2 ILE A 159  MET A 160  1  O  ILE A 159   N  SER A 149           
SHEET    1 AA3 2 ALA A 207  GLY A 211  0                                        
SHEET    2 AA3 2 VAL A 232  TYR A 236  1  O  ASP A 233   N  ALA A 207           
SHEET    1 AA4 3 TYR A 267  ASN A 270  0                                        
SHEET    2 AA4 3 LEU A 289  VAL A 293  1  O  VAL A 293   N  ASN A 270           
SHEET    3 AA4 3 ILE A 312  VAL A 314  1  O  ILE A 312   N  VAL A 290           
SHEET    1 AA5 2 THR B 466  GLN B 470  0                                        
SHEET    2 AA5 2 GLU B 473  ILE B 477 -1  O  ILE B 477   N  THR B 466           
SHEET    1 AA6 2 TYR B 482  GLU B 483  0                                        
SHEET    2 AA6 2 VAL B 489  ASN B 490 -1  O  VAL B 489   N  GLU B 483           
SSBOND   1 CYS A   49    CYS A   56                          1555   1555  2.03  
SSBOND   2 CYS A   54    CYS A  357                          1555   1555  2.10  
SSBOND   3 CYS A  102    CYS A  108                          1555   1555  2.04  
SSBOND   4 CYS A  263    CYS A  286                          1555   1555  2.10  
SSBOND   5 CYS B  456    CYS B  467                          1555   1555  2.05  
SSBOND   6 CYS B  461    CYS B  476                          1555   1555  2.05  
SSBOND   7 CYS B  478    CYS B  487                          1555   1555  2.06  
LINK         ND2 ASN A  53                 C1  NAG A 401     1555   1555  1.42  
LINK         ND2 ASN A 204                 C1  NAG A 402     1555   1555  1.43  
LINK         OE2 GLU B 455                CA    CA B3001     1555   1555  2.47  
LINK         OD1 ASP B 469                CA    CA B3001     1555   1555  2.38  
LINK         O   GLU B 473                CA    CA B3001     1555   1555  3.06  
CISPEP   1 GLU A  142    PRO A  143          0        -5.66                     
CISPEP   2 TRP A  174    PRO A  175          0         0.52                     
CISPEP   3 ILE A  384    PRO A  385          0         3.67                     
SITE     1 AC1 21 VAL A 173  ILE A 176  TYR A 177  LEU A 181                    
SITE     2 AC1 21 ARG A 210  GLY A 211  SER A 212  THR A 214                    
SITE     3 AC1 21 ARG A 218  THR A 237  ASP A 256  VAL A 257                    
SITE     4 AC1 21 LEU A 259  GLY A 273  SER A 277  ARG A 279                    
SITE     5 AC1 21 GOL A 404  HOH A 539  HOH A 588  HOH A 681                    
SITE     6 AC1 21 HOH B3106                                                     
SITE     1 AC2  8 ARG A 107  ASP A 133  ALA A 276  SER A 277                    
SITE     2 AC2  8 PHE A 278  UDP A 403  HOH A 669  SER B 458                    
SITE     1 AC3  3 ASP A 133  GLU B 455  HOH B3109                               
SITE     1 AC4  4 VAL B 453  GLU B 455  ASP B 469  GLU B 473                    
SITE     1 AC5 14 SER A  51  ASN A  53  SER A  55  ILE A 176                    
SITE     2 AC5 14 VAL A 257  HIS A 258  ASP A 261  HOH A 522                    
SITE     3 AC5 14 HOH A 558  HOH A 559  HOH A 576  HOH A 627                    
SITE     4 AC5 14 HOH A 672  HOH A 729                                          
SITE     1 AC6 10 GLY A 120  ARG A 121  ASN A 204  THR A 206                    
SITE     2 AC6 10 ASP A 233  TYR A 265  HOH A 582  HOH A 639                    
SITE     3 AC6 10 HOH A 673  HOH A 720                                          
CRYST1   70.580   73.560   83.280  90.00  90.00  90.00 P 21 21 21    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      0.014168  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.013594  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.012008        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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