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Database: PDB
Entry: 1GJH
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Original site: 1GJH 
HEADER    APOPTOSIS                               31-MAY-01   1GJH              
TITLE     HUMAN BCL-2, ISOFORM 2                                                
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: PROTEIN (APOPTOSIS REGULATOR BCL-2 WITH PUTATIVE           
COMPND   3 FLEXIBLE LOOP REPLACED WITH A PORTION OF APOPTOSIS                   
COMPND   4 REGULATOR BCL-X PROTEIN);                                            
COMPND   5 CHAIN: A;                                                            
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 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
KEYWDS    APOPTOSIS                                                             
EXPDTA    SOLUTION NMR                                                          
AUTHOR    A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON,K.SWIFT,           
AUTHOR   2 E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK                                 
REVDAT   2   24-FEB-09 1GJH    1       VERSN                                    
REVDAT   1   13-JUN-01 1GJH    0                                                
SPRSDE     13-JUN-01 1GJH      1G5O                                             
JRNL        AUTH   A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON,          
JRNL        AUTH 2 K.SWIFT,E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK                 
JRNL        TITL   SOLUTION STRUCTURE OF THE ANTIAPOPTOTIC PROTEIN              
JRNL        TITL 2 BCL-2.                                                       
JRNL        REF    PROC.NATL.ACAD.SCI.USA        V.  98  3012 2001              
JRNL        REFN                   ISSN 0027-8424                               
JRNL        PMID   11248023                                                     
JRNL        DOI    10.1073/PNAS.041619798                                       
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   M.L.CLEARY,S.D.SMITH,J.SKLAR                                 
REMARK   1  TITL   CLONING AND STRUCTURAL ANALYSIS OF CDNAS FOR BCL-2           
REMARK   1  TITL 2 AND A HYBRID BCL-2/IMMUNOGLOBULIN TRANSCRIPT                 
REMARK   1  TITL 3 RESULTING FROM THE T(14;18) TRANSLOCATION                    
REMARK   1  REF    CELL(CAMBRIDGE,MASS.)         V.  47    19 1986              
REMARK   1  REFN                   ISSN 0092-8674                               
REMARK   1  DOI    10.1016/0092-8674(86)90362-4                                 
REMARK   1 REFERENCE 2                                                          
REMARK   1  AUTH   M.SETO,U.JAEGER,R.D.HOCKETT,W.GRAINGER,S.BENNETT,            
REMARK   1  AUTH 2 P.GOLDMAN,S.J.KORSMEYER                                      
REMARK   1  TITL   ALTERNATIVE PROMOTERS AND EXONS, SOMATIC MUTATION            
REMARK   1  TITL 2 AND DEREGULATION OF THE BCL-2-IG FUSION GENE IN              
REMARK   1  TITL 3 LYMPHOMA                                                     
REMARK   1  REF    EMBO J.                       V.   7   123 1988              
REMARK   1  REFN                   ISSN 0261-4189                               
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CNX 2000                                             
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1GJH COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-JUN-01.                  
REMARK 100 THE RCSB ID CODE IS RCSB001583.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298.00                             
REMARK 210  PH                             : 7.80                               
REMARK 210  IONIC STRENGTH                 : 20 MM                              
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 15N-BCL-2(2); 15N,13C-BCL-         
REMARK 210                                   2(2); 15N, 13C-BCL-2(2)            
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 3D_15N-SEPARATED_NOESY, 3D_        
REMARK 210                                   13C-SEPARATED_NOESY                
REMARK 210  SPECTROMETER FIELD STRENGTH    : 800 MHZ, 600 MHZ, 500 MHZ          
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : NULL                               
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                
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 465                                                                      
REMARK 465 MISSING RESIDUES                                                     
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER;                   
REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                            
REMARK 465     RES C SSSEQI                                                     
REMARK 465     MET A     1                                                      
REMARK 465     ALA A     2                                                      
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    ALA A   4       74.50   -179.09                                   
REMARK 500    ARG A   6       31.15   -144.59                                   
REMARK 500    GLU A  29       83.99    -66.35                                   
REMARK 500    GLU A  38       85.87     43.48                                   
REMARK 500    ARG A  40       57.11   -107.97                                   
REMARK 500    THR A  41      -78.04    -49.86                                   
REMARK 500    ALA A  43      151.40     68.76                                   
REMARK 500    GLU A  48      -73.17    -50.97                                   
REMARK 500    ASP A 111      -50.22   -172.87                                   
REMARK 500    GLN A 118       57.82    -90.55                                   
REMARK 500    PHE A 124      149.42   -177.69                                   
REMARK 500    PHE A 138       66.17   -112.23                                   
REMARK 500    ASP A 140      -74.76    -80.88                                   
REMARK 500    ARG A 164      -74.98    -78.94                                   
REMARK 500    GLU A 165       63.61   -175.74                                   
REMARK 500    MET A 166       43.03   -149.44                                   
REMARK 500    HIS A 184      -35.97   -143.66                                   
REMARK 500    ASN A 192       52.45   -110.60                                   
REMARK 500    PRO A 204      160.24    -41.95                                   
REMARK 500    SER A 205       95.19    -47.45                                   
REMARK 500    MET A 206       79.47     45.57                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1BXL   RELATED DB: PDB                                   
REMARK 900 STRUCTURE OF BCL-XL/BAK PEPTIDE COMPLEX, NMR, MINIMIZED              
REMARK 900 AVERAGE STRUCTURE                                                    
REMARK 900 RELATED ID: 1G5J   RELATED DB: PDB                                   
REMARK 900 COMPLEX OF BCL-XL WITH PEPTIDE FROM BAD                              
REMARK 900 RELATED ID: 1G5M   RELATED DB: PDB                                   
REMARK 900 HUMAN BCL-2, ISOFORM 1                                               
DBREF  1GJH A    1    34  UNP    P10415   BCL2_HUMAN       1     34             
DBREF  1GJH A   35    50  UNP    Q07817   BCLX_HUMAN      29     44             
DBREF  1GJH A   92   207  UNP    P10415   BCL2_HUMAN      92    207             
SEQRES   1 A  166  MET ALA HIS ALA GLY ARG THR GLY TYR ASP ASN ARG GLU          
SEQRES   2 A  166  ILE VAL MET LYS TYR ILE HIS TYR LYS LEU SER GLN ARG          
SEQRES   3 A  166  GLY TYR GLU TRP ASP ALA GLY ASP ASP VAL GLU GLU ASN          
SEQRES   4 A  166  ARG THR GLU ALA PRO GLU GLY THR GLU SER GLU VAL VAL          
SEQRES   5 A  166  HIS LEU THR LEU ARG GLN ALA GLY ASP ASP PHE SER ARG          
SEQRES   6 A  166  ARG TYR ARG ARG ASP PHE ALA GLU MET SER SER GLN LEU          
SEQRES   7 A  166  HIS LEU THR PRO PHE THR ALA ARG GLY ARG PHE ALA THR          
SEQRES   8 A  166  VAL VAL GLU GLU LEU PHE ARG ASP GLY VAL ASN TRP GLY          
SEQRES   9 A  166  ARG ILE VAL ALA PHE PHE GLU PHE GLY GLY VAL MET CYS          
SEQRES  10 A  166  VAL GLU SER VAL ASN ARG GLU MET SER PRO LEU VAL ASP          
SEQRES  11 A  166  ASN ILE ALA LEU TRP MET THR GLU TYR LEU ASN ARG HIS          
SEQRES  12 A  166  LEU HIS THR TRP ILE GLN ASP ASN GLY GLY TRP ASP ALA          
SEQRES  13 A  166  PHE VAL GLU LEU TYR GLY PRO SER MET ARG                      
HELIX    1   1 ASP A   10  GLN A   25  1                                  16    
HELIX    2   2 GLY A   46  TYR A  108  1                                  22    
HELIX    3   3 PHE A  112  SER A  117  1                                   6    
HELIX    4   4 THR A  125  PHE A  138  1                                  14    
HELIX    5   5 ASN A  143  GLU A  165  1                                  23    
HELIX    6   6 PRO A  168  ASP A  191  1                                  24    
HELIX    7   7 GLY A  194  TYR A  202  1                                   9    
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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