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Database: PDB
Entry: 1PES
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Original site: 1PES 
HEADER    DNA-BINDING                             24-NOV-94   1PES              
TITLE     NMR SOLUTION STRUCTURE OF THE TETRAMERIC MINIMUM                      
TITLE    2 TRANSFORMING DOMAIN OF P53                                           
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: TUMOR SUPPRESSOR P53;                                      
COMPND   3 CHAIN: A, B, C, D;                                                   
COMPND   4 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: HUMAN;                                                         
SOURCE   6 EXPRESSION_SYSTEM_STRAIN: PET;                                       
SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PET;                                  
SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET 19B GENE: HUMAN                       
KEYWDS    DNA-BINDING                                                           
EXPDTA    SOLUTION NMR                                                          
AUTHOR    W.LEE,T.S.HARVEY,Y.YIN,P.YAU,D.LITCHFIELD,C.H.ARROWSMITH              
REVDAT   3   24-FEB-09 1PES    1       VERSN                                    
REVDAT   2   01-APR-03 1PES    1       JRNL                                     
REVDAT   1   07-FEB-95 1PES    0                                                
JRNL        AUTH   W.LEE,T.S.HARVEY,Y.YIN,P.YAU,D.LITCHFIELD,                   
JRNL        AUTH 2 C.H.ARROWSMITH                                               
JRNL        TITL   SOLUTION STRUCTURE OF THE TETRAMERIC MINIMUM                 
JRNL        TITL 2 TRANSFORMING DOMAIN OF P53.                                  
JRNL        REF    NAT.STRUCT.BIOL.              V.   1   877 1994              
JRNL        REFN                   ISSN 1072-8368                               
JRNL        PMID   7773777                                                      
JRNL        DOI    10.1038/NSB1294-877                                          
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR                                               
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1PES COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.                                
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : NULL                               
REMARK 210  PH                             : NULL                               
REMARK 210  IONIC STRENGTH                 : NULL                               
REMARK 210  PRESSURE                       : NULL                               
REMARK 210  SAMPLE CONTENTS                : NULL                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : NULL                               
REMARK 210  SPECTROMETER FIELD STRENGTH    : NULL                               
REMARK 210  SPECTROMETER MODEL             : NULL                               
REMARK 210  SPECTROMETER MANUFACTURER      : NULL                               
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : NULL                               
REMARK 210   METHOD USED                   : NULL                               
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : NULL                               
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : NULL                               
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
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 335      -52.03   -166.83                                   
REMARK 500    ARG B 335      -52.25   -166.82                                   
REMARK 500    ARG C 335      -52.27   -166.82                                   
REMARK 500    ARG D 335      -52.29   -166.77                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500    ARG A 333         0.28    SIDE_CHAIN                              
REMARK 500    ARG A 335         0.32    SIDE_CHAIN                              
REMARK 500    ARG A 337         0.30    SIDE_CHAIN                              
REMARK 500    ARG A 342         0.32    SIDE_CHAIN                              
REMARK 500    ARG B 333         0.28    SIDE_CHAIN                              
REMARK 500    ARG B 335         0.32    SIDE_CHAIN                              
REMARK 500    ARG B 337         0.30    SIDE_CHAIN                              
REMARK 500    ARG B 342         0.32    SIDE_CHAIN                              
REMARK 500    ARG C 333         0.28    SIDE_CHAIN                              
REMARK 500    ARG C 335         0.32    SIDE_CHAIN                              
REMARK 500    ARG C 337         0.30    SIDE_CHAIN                              
REMARK 500    ARG C 342         0.32    SIDE_CHAIN                              
REMARK 500    ARG D 333         0.28    SIDE_CHAIN                              
REMARK 500    ARG D 335         0.32    SIDE_CHAIN                              
REMARK 500    ARG D 337         0.30    SIDE_CHAIN                              
REMARK 500    ARG D 342         0.32    SIDE_CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1PET   RELATED DB: PDB                                   
DBREF  1PES A  325   355  UNP    P04637   P53_HUMAN      325    355             
DBREF  1PES B  325   355  UNP    P04637   P53_HUMAN      325    355             
DBREF  1PES C  325   355  UNP    P04637   P53_HUMAN      325    355             
DBREF  1PES D  325   355  UNP    P04637   P53_HUMAN      325    355             
SEQRES   1 A   31  GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG          
SEQRES   2 A   31  PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU          
SEQRES   3 A   31  LYS ASP ALA GLN ALA                                          
SEQRES   1 B   31  GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG          
SEQRES   2 B   31  PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU          
SEQRES   3 B   31  LYS ASP ALA GLN ALA                                          
SEQRES   1 C   31  GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG          
SEQRES   2 C   31  PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU          
SEQRES   3 C   31  LYS ASP ALA GLN ALA                                          
SEQRES   1 D   31  GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG          
SEQRES   2 D   31  PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU          
SEQRES   3 D   31  LYS ASP ALA GLN ALA                                          
HELIX    1   1 GLU A  336  ALA A  353  1                                  18    
HELIX    2   2 GLU B  336  ALA B  353  1                                  18    
HELIX    3   3 GLU C  336  ALA C  353  1                                  18    
HELIX    4   4 GLU D  336  ALA D  353  1                                  18    
SHEET    1   A 2 GLU A 326  PHE A 328  0                                        
SHEET    2   A 2 ILE B 332  GLY B 334 -1  N  GLY B 334   O  GLU A 326           
SHEET    1   B 2 ILE A 332  GLY A 334  0                                        
SHEET    2   B 2 GLU B 326  PHE B 328 -1  N  PHE B 328   O  ILE A 332           
SHEET    1   C 2 GLU C 326  PHE C 328  0                                        
SHEET    2   C 2 ILE D 332  GLY D 334 -1  N  GLY D 334   O  GLU C 326           
SHEET    1   D 2 ILE C 332  GLY C 334  0                                        
SHEET    2   D 2 GLU D 326  PHE D 328 -1  N  PHE D 328   O  ILE C 332           
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
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      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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