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Database: PDB
Entry: 5YBC
LinkDB: 5YBC
Original site: 5YBC 
HEADER    STRUCTURAL PROTEIN                      04-SEP-17   5YBC              
TITLE     X-RAY STRUCTURE OF NATIVE ETS-DOMAIN DOMAIN OF ERGP55                 
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: TRANSCRIPTIONAL REGULATOR ERG;                             
COMPND   3 CHAIN: C, A;                                                         
COMPND   4 FRAGMENT: ETS DOMAIN, UNP RESIDUES 317-408;                          
COMPND   5 SYNONYM: TRANSFORMING PROTEIN ERG;                                   
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: ERG;                                                           
SOURCE   6 EXPRESSION_SYSTEM: ENTEROBACTERIA PHAGE L1;                          
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 268588                                      
KEYWDS    ETS TRANSCRIPTION FACTOR, ERGP55, STRUCTURAL PROTEIN                  
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    A.K.SAXENA,S.P.GANGWAR                                                
REVDAT   2   17-OCT-18 5YBC    1       JRNL                                     
REVDAT   1   19-SEP-18 5YBC    0                                                
JRNL        AUTH   R.SHARMA,S.P.GANGWAR,A.K.SAXENA                              
JRNL        TITL   COMPARATIVE STRUCTURE ANALYSIS OF THE ETSI DOMAIN OF ERG3    
JRNL        TITL 2 AND ITS COMPLEX WITH THE E74 PROMOTER DNA SEQUENCE           
JRNL        REF    ACTA CRYSTALLOGR F STRUCT     V.  74   656 2018              
JRNL        REF  2 BIOL COMMUN                                                  
JRNL        REFN                   ESSN 2053-230X                               
JRNL        PMID   30279318                                                     
JRNL        DOI    10.1107/S2053230X1801110X                                    
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.50 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX 1.8.2_1309                                    
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) : 2.50                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 32.28                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.330                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 99.2                           
REMARK   3   NUMBER OF REFLECTIONS             : 9874                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.224                           
REMARK   3   R VALUE            (WORKING SET) : 0.222                           
REMARK   3   FREE R VALUE                     : 0.257                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.120                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 506                             
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 32.2852 -  3.9665    0.99     2456   144  0.1806 0.1899        
REMARK   3     2  3.9665 -  3.1492    0.99     2311   126  0.2430 0.3197        
REMARK   3     3  3.1492 -  2.7513    1.00     2316   123  0.3184 0.4184        
REMARK   3     4  2.7513 -  2.4999    1.00     2285   113  0.2961 0.3547        
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)     : 0.370            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 31.790           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 60.86                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 69.22                          
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      :  0.010           1577                                  
REMARK   3   ANGLE     :  1.368           2119                                  
REMARK   3   CHIRALITY :  0.056            209                                  
REMARK   3   PLANARITY :  0.007            270                                  
REMARK   3   DIHEDRAL  : 14.628            594                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 1                                          
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: ALL                                                    
REMARK   3    ORIGIN FOR THE GROUP (A):  -5.1384   0.3988 -18.7748              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4755 T22:   0.4936                                     
REMARK   3      T33:   0.4693 T12:  -0.0009                                     
REMARK   3      T13:  -0.0684 T23:  -0.0288                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.6909 L22:   0.6486                                     
REMARK   3      L33:   0.5186 L12:  -0.4174                                     
REMARK   3      L13:   0.3326 L23:   0.3295                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0376 S12:  -0.1543 S13:   0.0560                       
REMARK   3      S21:   0.1166 S22:   0.1141 S23:  -0.0453                       
REMARK   3      S31:   0.3221 S32:  -0.0048 S33:   0.0000                       
REMARK   3                                                                      
REMARK   3  NCS DETAILS                                                         
REMARK   3   NUMBER OF NCS GROUPS : 1                                           
REMARK   3   NCS GROUP : 1                                                      
REMARK   3    NCS OPERATOR : 1                                                  
REMARK   3     REFERENCE SELECTION: CHAIN A AND SEGID A                         
REMARK   3     SELECTION          : CHAIN C AND SEGID C                         
REMARK   3     ATOM PAIRS NUMBER  : 867                                         
REMARK   3     RMSD               : NULL                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 5YBC COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 05-SEP-17.                  
REMARK 100 THE DEPOSITION ID IS D_1300004983.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 10-APR-13                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 5.0-5.6                            
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : ESRF                               
REMARK 200  BEAMLINE                       : BM14                               
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.97625                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : GRAZING ANGLE 2.8 MRAD             
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : MARMOSAIC 225 MM CCD               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : NULL                               
REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 9971                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.500                              
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     (%) : 99.6                               
REMARK 200  DATA REDUNDANCY                : 27.50                              
REMARK 200  R MERGE                    (I) : 0.06800                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 11.8000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.50                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.54                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 99.4                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 25.70                              
REMARK 200  R MERGE FOR SHELL          (I) : 0.98900                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: RECTANGULAR BYPYRAMID                                        
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 59.73                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.05                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 20%(W/V) PEG400, 130MM NACL, 60MM        
REMARK 280  MGCL2, 100MM SODIUM CITRATE PH 5.6, VAPOR DIFFUSION, HANGING        
REMARK 280  DROP, TEMPERATURE 277K                                              
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 41 21 2                        
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,-Y,Z+1/2                                             
REMARK 290       3555   -Y+1/2,X+1/2,Z+1/4                                      
REMARK 290       4555   Y+1/2,-X+1/2,Z+3/4                                      
REMARK 290       5555   -X+1/2,Y+1/2,-Z+1/4                                     
REMARK 290       6555   X+1/2,-Y+1/2,-Z+3/4                                     
REMARK 290       7555   Y,X,-Z                                                  
REMARK 290       8555   -Y,-X,-Z+1/2                                            
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        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       64.15250            
REMARK 290   SMTRY1   3  0.000000 -1.000000  0.000000       32.28250            
REMARK 290   SMTRY2   3  1.000000  0.000000  0.000000       32.28250            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000       32.07625            
REMARK 290   SMTRY1   4  0.000000  1.000000  0.000000       32.28250            
REMARK 290   SMTRY2   4 -1.000000  0.000000  0.000000       32.28250            
REMARK 290   SMTRY3   4  0.000000  0.000000  1.000000       96.22875            
REMARK 290   SMTRY1   5 -1.000000  0.000000  0.000000       32.28250            
REMARK 290   SMTRY2   5  0.000000  1.000000  0.000000       32.28250            
REMARK 290   SMTRY3   5  0.000000  0.000000 -1.000000       32.07625            
REMARK 290   SMTRY1   6  1.000000  0.000000  0.000000       32.28250            
REMARK 290   SMTRY2   6  0.000000 -1.000000  0.000000       32.28250            
REMARK 290   SMTRY3   6  0.000000  0.000000 -1.000000       96.22875            
REMARK 290   SMTRY1   7  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY2   7  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY3   7  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1   8  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY2   8 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY3   8  0.000000  0.000000 -1.000000       64.15250            
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 APPLY THE FOLLOWING TO CHAINS: C, 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 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     PRO C   401                                                      
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    LEU A 399       38.13    -70.97                                   
REMARK 500    GLN A 400      -46.27   -132.15                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue GOL A 501                 
DBREF  5YBC C  310   401  UNP    P11308   ERG_HUMAN      317    408             
DBREF  5YBC A  310   401  UNP    P11308   ERG_HUMAN      317    408             
SEQRES   1 C   92  GLN ILE GLN LEU TRP GLN PHE LEU LEU GLU LEU LEU SER          
SEQRES   2 C   92  ASP SER SER ASN SER SER CYS ILE THR TRP GLU GLY THR          
SEQRES   3 C   92  ASN GLY GLU PHE LYS MET THR ASP PRO ASP GLU VAL ALA          
SEQRES   4 C   92  ARG ARG TRP GLY GLU ARG LYS SER LYS PRO ASN MET ASN          
SEQRES   5 C   92  TYR ASP LYS LEU SER ARG ALA LEU ARG TYR TYR TYR ASP          
SEQRES   6 C   92  LYS ASN ILE MET THR LYS VAL HIS GLY LYS ARG TYR ALA          
SEQRES   7 C   92  TYR LYS PHE ASP PHE HIS GLY ILE ALA GLN ALA LEU GLN          
SEQRES   8 C   92  PRO                                                          
SEQRES   1 A   92  GLN ILE GLN LEU TRP GLN PHE LEU LEU GLU LEU LEU SER          
SEQRES   2 A   92  ASP SER SER ASN SER SER CYS ILE THR TRP GLU GLY THR          
SEQRES   3 A   92  ASN GLY GLU PHE LYS MET THR ASP PRO ASP GLU VAL ALA          
SEQRES   4 A   92  ARG ARG TRP GLY GLU ARG LYS SER LYS PRO ASN MET ASN          
SEQRES   5 A   92  TYR ASP LYS LEU SER ARG ALA LEU ARG TYR TYR TYR ASP          
SEQRES   6 A   92  LYS ASN ILE MET THR LYS VAL HIS GLY LYS ARG TYR ALA          
SEQRES   7 A   92  TYR LYS PHE ASP PHE HIS GLY ILE ALA GLN ALA LEU GLN          
SEQRES   8 A   92  PRO                                                          
HET    GOL  A 501       6                                                       
HETNAM     GOL GLYCEROL                                                         
HETSYN     GOL GLYCERIN; PROPANE-1,2,3-TRIOL                                    
FORMUL   3  GOL    C3 H8 O3                                                     
HELIX    1 AA1 GLN C  312  ASP C  323  1                                  12    
HELIX    2 AA2 SER C  324  CYS C  329  5                                   6    
HELIX    3 AA3 ASP C  343  LYS C  355  1                                  13    
HELIX    4 AA4 ASN C  361  TYR C  371  1                                  11    
HELIX    5 AA5 TYR C  372  LYS C  375  5                                   4    
HELIX    6 AA6 ASP C  391  GLN C  400  1                                  10    
HELIX    7 AA7 GLN A  312  ASP A  323  1                                  12    
HELIX    8 AA8 SER A  324  SER A  328  5                                   5    
HELIX    9 AA9 ASP A  343  LYS A  355  1                                  13    
HELIX   10 AB1 ASN A  361  TYR A  372  1                                  12    
HELIX   11 AB2 TYR A  373  LYS A  375  5                                   3    
HELIX   12 AB3 ASP A  391  LEU A  399  1                                   9    
SHEET    1 AA1 4 THR C 331  GLU C 333  0                                        
SHEET    2 AA1 4 GLU C 338  LYS C 340 -1  O  GLU C 338   N  GLU C 333           
SHEET    3 AA1 4 ALA C 387  PHE C 390 -1  O  TYR C 388   N  PHE C 339           
SHEET    4 AA1 4 MET C 378  LYS C 380 -1  N  THR C 379   O  LYS C 389           
SHEET    1 AA2 4 ILE A 330  GLU A 333  0                                        
SHEET    2 AA2 4 GLU A 338  MET A 341 -1  O  LYS A 340   N  THR A 331           
SHEET    3 AA2 4 ALA A 387  PHE A 390 -1  O  TYR A 388   N  PHE A 339           
SHEET    4 AA2 4 MET A 378  LYS A 380 -1  N  THR A 379   O  LYS A 389           
CISPEP   1 PRO C  358    ASN C  359          0        -1.51                     
SITE     1 AC1  3 ARG A 370  LYS A 380  ARG A 385                               
CRYST1   64.565   64.565  128.305  90.00  90.00  90.00 P 41 21 2    16          
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      0.015488  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.015488  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.007794        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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