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Entry: 1KBH
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HEADER    TRANSCRIPTION                           06-NOV-01   1KBH              
TITLE     MUTUAL SYNERGISTIC FOLDING IN THE INTERACTION BETWEEN                 
TITLE    2 NUCLEAR RECEPTOR COACTIVATORS CBP AND ACTR                           
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: NUCLEAR RECEPTOR COACTIVATOR;                              
COMPND   3 CHAIN: A;                                                            
COMPND   4 SYNONYM: ACTR;                                                       
COMPND   5 ENGINEERED: YES;                                                     
COMPND   6 MOL_ID: 2;                                                           
COMPND   7 MOLECULE: CREB-BINDING PROTEIN;                                      
COMPND   8 CHAIN: B;                                                            
COMPND   9 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: ACTR;                                                          
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21-DE3(DNAY);                            
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET22B;                                   
SOURCE  11 MOL_ID: 2;                                                           
SOURCE  12 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
SOURCE  13 ORGANISM_COMMON: HOUSE MOUSE;                                        
SOURCE  14 ORGANISM_TAXID: 10090;                                               
SOURCE  15 GENE: CBP;                                                           
SOURCE  16 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE  17 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE  18 EXPRESSION_SYSTEM_STRAIN: BL21-DE3(DNAY);                            
SOURCE  19 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  20 EXPRESSION_SYSTEM_PLASMID: PET22B                                    
KEYWDS    NUCLEAR HORMONE RECEPTORS, P160, ACTR, CBP, CREB-BINDING              
KEYWDS   2 PROTEIN, P300, COACTIVATOR, TRANSCRIPTION                            
EXPDTA    SOLUTION NMR                                                          
NUMMDL    20                                                                    
AUTHOR    S.J.DEMAREST,M.MARTINEZ-YAMOUT,J.CHUNG,H.CHEN,W.XU,                   
AUTHOR   2 H.J.DYSON,R.M.EVANS,P.E.WRIGHT                                       
REVDAT   2   24-FEB-09 1KBH    1       VERSN                                    
REVDAT   1   06-FEB-02 1KBH    0                                                
JRNL        AUTH   S.J.DEMAREST,M.MARTINEZ-YAMOUT,J.CHUNG,H.CHEN,W.XU,          
JRNL        AUTH 2 H.J.DYSON,R.M.EVANS,P.E.WRIGHT                               
JRNL        TITL   MUTUAL SYNERGISTIC FOLDING IN RECRUITMENT OF                 
JRNL        TITL 2 CBP/P300 BY P160 NUCLEAR RECEPTOR COACTIVATORS.              
JRNL        REF    NATURE                        V. 415   549 2002              
JRNL        REFN                   ISSN 0028-0836                               
JRNL        PMID   11823864                                                     
JRNL        DOI    10.1038/415549A                                              
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : DYANA 1.5, AMBER 5.0                                 
REMARK   3   AUTHORS     : WUTHRICH, ET AL. (DYANA), CASE, ET AL. (AMBER)       
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: 200 STRUCTURES ORIGINALLY CALCULATED      
REMARK   3  USING UNAMBIGUOUS RESTRAINTS IN DYANA FOLLOWED BY THE ADDITION      
REMARK   3  OF AMBIGUOUS RESTRAINTS FOR SIMULATED ANNEALING OF THE TOP 100      
REMARK   3  DYANA STRUCTURES IN AMBER. BEST 20 STRUCTURES SELECTED TO           
REMARK   3  REPRESENT THE STRUCTURE OF THE ACTR/CBP COMPLEX.                    
REMARK   4                                                                      
REMARK   4 1KBH COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-NOV-01.                  
REMARK 100 THE RCSB ID CODE IS RCSB014777.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 31; 31; 31; 31; 31; 31             
REMARK 210  PH                             : 6.6; 6.6; 6.6; 6.6; 6.6; 6.6       
REMARK 210  IONIC STRENGTH                 : 60 MM; 60 MM; 60 MM; 60 MM;        
REMARK 210                                   60 MM; 60 MM                       
REMARK 210  PRESSURE                       : AMBIENT; AMBIENT; AMBIENT;         
REMARK 210                                   AMBIENT; AMBIENT; AMBIENT          
REMARK 210  SAMPLE CONTENTS                : 3MM U-15N,13C-CBP:2059-2117        
REMARK 210                                   6MM 14N,12C-ACTR:1018-1088;        
REMARK 210                                   3MM U-15N,12C-CBP:2059-2117        
REMARK 210                                   6MM 14N,12C-ACTR:1018-1088;        
REMARK 210                                   3MM U-15N,13C-CBP:2059-2117        
REMARK 210                                   6MM 14N,12C-ACTR:1018-1088;        
REMARK 210                                   2MM U-15N,13C-ACTR:1018-1088       
REMARK 210                                   4MM 14N,12C-CBP:2059-2117; 2MM     
REMARK 210                                   U-15N,12C-ACTR:1018-1088 4MM       
REMARK 210                                   14N,12C-CBP:2059-2117; 2MM U-      
REMARK 210                                   15N,13C-ACTR:1018-1088 4MM         
REMARK 210                                   14N,12C-CBP:2059-2117              
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 3D_13C-SEPARATED_NOESY, 4D_        
REMARK 210                                   13C-SEPARATED_NOESY, 3D_15N-       
REMARK 210                                   SEPARATED_NOESY, 12C-FILTERED/     
REMARK 210                                   13C-EDITED-NOESY, HNHA, HNHB       
REMARK 210  SPECTROMETER FIELD STRENGTH    : 600 MHZ, 500 MHZ, 750 MHZ,         
REMARK 210                                   800 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DRX, AMX, DMX                      
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : NMRPIPE 1, XWINNMR 1, UXNMR        
REMARK 210                                   1, NMRVIEW 3.0                     
REMARK 210   METHOD USED                   : DYANA, SANE, AMBER                 
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LEAST          
REMARK 210                                   RESTRAINT VIOLATIONS,              
REMARK 210                                   STRUCTURES WITH THE LOWEST         
REMARK 210                                   ENERGY                             
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
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: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500  1 ARG A   7   NE  -  CZ  -  NH1 ANGL. DEV. =   3.5 DEGREES          
REMARK 500  1 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -8.8 DEGREES          
REMARK 500  3 ARG A   7   CD  -  NE  -  CZ  ANGL. DEV. =   8.5 DEGREES          
REMARK 500  3 ARG A   7   NE  -  CZ  -  NH1 ANGL. DEV. =   3.9 DEGREES          
REMARK 500  3 PRO B  48   CA  -  N   -  CD  ANGL. DEV. = -10.7 DEGREES          
REMARK 500  3 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   3.1 DEGREES          
REMARK 500  3 ARG B  62   NE  -  CZ  -  NH1 ANGL. DEV. =   3.0 DEGREES          
REMARK 500  3 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.5 DEGREES          
REMARK 500  4 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -8.6 DEGREES          
REMARK 500  4 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   4.5 DEGREES          
REMARK 500  5 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   3.5 DEGREES          
REMARK 500  6 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -9.2 DEGREES          
REMARK 500  6 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   3.1 DEGREES          
REMARK 500  7 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.1 DEGREES          
REMARK 500  8 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -9.6 DEGREES          
REMARK 500  9 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.7 DEGREES          
REMARK 500 10 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   4.0 DEGREES          
REMARK 500 10 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   5.1 DEGREES          
REMARK 500 11 ARG A   7   NE  -  CZ  -  NH1 ANGL. DEV. =   3.1 DEGREES          
REMARK 500 11 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -8.8 DEGREES          
REMARK 500 12 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.5 DEGREES          
REMARK 500 12 ARG B  94   NE  -  CZ  -  NH1 ANGL. DEV. =   3.4 DEGREES          
REMARK 500 13 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500 13 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.6 DEGREES          
REMARK 500 14 ARG A   7   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.0 DEGREES          
REMARK 500 14 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   3.7 DEGREES          
REMARK 500 14 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500 14 ARG B  50   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.2 DEGREES          
REMARK 500 14 ARG B  94   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.1 DEGREES          
REMARK 500 15 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   3.5 DEGREES          
REMARK 500 15 PRO B  48   CA  -  N   -  CD  ANGL. DEV. = -11.2 DEGREES          
REMARK 500 15 ARG B  62   NE  -  CZ  -  NH1 ANGL. DEV. =   3.1 DEGREES          
REMARK 500 15 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.7 DEGREES          
REMARK 500 16 ARG A  30   CD  -  NE  -  CZ  ANGL. DEV. =   9.1 DEGREES          
REMARK 500 16 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   3.2 DEGREES          
REMARK 500 16 PRO B  70   CA  -  N   -  CD  ANGL. DEV. =  -9.2 DEGREES          
REMARK 500 16 ARG B  94   NE  -  CZ  -  NH1 ANGL. DEV. =   3.5 DEGREES          
REMARK 500 17 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   3.6 DEGREES          
REMARK 500 17 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -8.9 DEGREES          
REMARK 500 17 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   4.3 DEGREES          
REMARK 500 17 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =  11.0 DEGREES          
REMARK 500 18 PRO B  48   CA  -  N   -  CD  ANGL. DEV. = -11.2 DEGREES          
REMARK 500 19 PRO B  48   CA  -  N   -  CD  ANGL. DEV. =  -8.8 DEGREES          
REMARK 500 19 ARG B  50   NE  -  CZ  -  NH1 ANGL. DEV. =   4.3 DEGREES          
REMARK 500 19 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =   9.3 DEGREES          
REMARK 500 20 THR B  63   CA  -  CB  -  CG2 ANGL. DEV. =  10.7 DEGREES          
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  1 GLN A   3       79.29     -1.29                                   
REMARK 500  1 SER A   4      -73.48   -132.75                                   
REMARK 500  1 SER A  18       21.85   -143.90                                   
REMARK 500  1 ASN A  19        4.72    -57.42                                   
REMARK 500  1 THR A  20      -85.04    130.32                                   
REMARK 500  1 ASN B  49      -62.45   -159.80                                   
REMARK 500  1 ARG B  50      -72.12    -62.04                                   
REMARK 500  1 SER B  68       23.69    -61.83                                   
REMARK 500  1 SER B  69      -68.12    -90.09                                   
REMARK 500  1 GLN B  74        1.50    -55.72                                   
REMARK 500  1 ASN B 101      -44.05   -130.75                                   
REMARK 500  2 GLN A   3      -19.24     71.26                                   
REMARK 500  2 ASN A  19       -6.42    -43.70                                   
REMARK 500  2 THR A  20      -28.57    121.02                                   
REMARK 500  2 GLN A  42       42.76    -68.15                                   
REMARK 500  2 PRO A  46       16.07    -68.78                                   
REMARK 500  2 GLN B  74        5.94    -63.10                                   
REMARK 500  2 ASN B 101      -35.13   -141.27                                   
REMARK 500  2 MET B 105       29.36   -141.36                                   
REMARK 500  3 GLN A   3      -36.95     62.61                                   
REMARK 500  3 SER A  18       13.94   -143.29                                   
REMARK 500  3 ASN A  19       -6.02    -49.39                                   
REMARK 500  3 THR A  20      -16.98    112.04                                   
REMARK 500  3 ALA A  22       -9.80   -143.95                                   
REMARK 500  3 PRO A  46        8.88    -61.70                                   
REMARK 500  3 GLN B  74       -7.15    -55.06                                   
REMARK 500  3 PRO B 103       -6.92    -54.90                                   
REMARK 500  4 GLN A   3        3.76     57.48                                   
REMARK 500  4 ASN A  19       -3.61    -40.10                                   
REMARK 500  4 THR A  20      -17.58    109.95                                   
REMARK 500  4 ALA A  22       -5.24   -145.43                                   
REMARK 500  4 ALA A  43      -24.04   -163.00                                   
REMARK 500  4 PRO A  46       -5.18    -57.70                                   
REMARK 500  4 ASN B  49      -74.21   -133.82                                   
REMARK 500  4 GLN B 102       83.61   -152.33                                   
REMARK 500  4 PRO B 103       58.41    -61.15                                   
REMARK 500  5 GLN A   3      -45.21     58.65                                   
REMARK 500  5 THR A  20      -19.45    121.09                                   
REMARK 500  5 ALA A  22      -11.48   -147.82                                   
REMARK 500  5 ASN B  49      -88.47    179.63                                   
REMARK 500  5 GLN B  58      -60.41    -92.26                                   
REMARK 500  5 GLN B  71       36.43    -81.93                                   
REMARK 500  5 GLN B  74       18.52    -65.21                                   
REMARK 500  6 GLN A   3       58.82     76.59                                   
REMARK 500  6 SER A   4      -42.04   -179.94                                   
REMARK 500  6 ASN A  19       -5.81    -48.81                                   
REMARK 500  6 THR A  20      -18.82    116.84                                   
REMARK 500  6 ALA A  22       -9.28   -144.18                                   
REMARK 500  6 PRO A  46        7.90    -66.95                                   
REMARK 500  6 ASN B  49      -38.23   -131.59                                   
REMARK 500  6 SER B  68        3.20    -59.90                                   
REMARK 500  6 GLN B  72        5.25    -58.61                                   
REMARK 500  6 GLN B  74       -7.87    -51.77                                   
REMARK 500  7 GLN A   3      -39.14     63.90                                   
REMARK 500  7 LEU A  16      -60.42    -90.96                                   
REMARK 500  7 SER A  18       35.73   -152.05                                   
REMARK 500  7 THR A  20      -69.63   -157.19                                   
REMARK 500  7 ASN B  49      -41.06   -132.10                                   
REMARK 500  7 ARG B  50      -64.18    -96.52                                   
REMARK 500  7 GLN B  58      -60.24    -92.17                                   
REMARK 500  7 SER B  68       16.71    -56.88                                   
REMARK 500  7 SER B  69      -74.12    -86.31                                   
REMARK 500  7 GLN B  72     -174.92    -62.74                                   
REMARK 500  7 ASN B 101      -32.53   -142.80                                   
REMARK 500  8 GLN A   3      -31.89    105.39                                   
REMARK 500  8 ASN A  19       -0.24    -55.82                                   
REMARK 500  8 THR A  20      -25.35    111.31                                   
REMARK 500  8 ALA A  22       -1.01   -146.82                                   
REMARK 500  8 GLN B  72        4.34    -64.44                                   
REMARK 500  8 GLN B  74      -13.52    -48.01                                   
REMARK 500  9 GLN A   3      -30.28     60.70                                   
REMARK 500  9 ASN A  19       -6.83    -53.50                                   
REMARK 500  9 THR A  20      -17.61    117.56                                   
REMARK 500  9 SER B  68       15.67    -58.37                                   
REMARK 500  9 SER B  69      -81.80    -76.52                                   
REMARK 500  9 GLN B  74       -2.44    -51.22                                   
REMARK 500  9 ASN B 101      -37.41     69.80                                   
REMARK 500 10 GLN A   3       -6.59     54.40                                   
REMARK 500 10 ASN A  19       -5.62    -47.04                                   
REMARK 500 10 THR A  20      -18.96    112.08                                   
REMARK 500 10 ALA A  22       -1.16   -145.67                                   
REMARK 500 10 GLN B  58      -60.01    -90.97                                   
REMARK 500 10 GLN B  72       13.95    -65.33                                   
REMARK 500 10 GLN B  74      -11.95    -49.73                                   
REMARK 500 10 ASN B 101      -21.69   -142.39                                   
REMARK 500 10 MET B 105      -19.51     33.28                                   
REMARK 500 11 GLN A   3      -30.30     61.43                                   
REMARK 500 11 ASP A   5      -60.34    -94.81                                   
REMARK 500 11 ASN A  19       -0.67    -52.08                                   
REMARK 500 11 THR A  20      -16.73    115.68                                   
REMARK 500 11 ALA A  22       -4.86   -143.49                                   
REMARK 500 11 ASN B  49      -59.73   -134.33                                   
REMARK 500 11 GLN B  58      -60.48    -90.74                                   
REMARK 500 11 GLN B  72       46.36    -71.63                                   
REMARK 500 12 GLN A   3      -36.31     75.70                                   
REMARK 500 12 THR A  20      -10.15    121.25                                   
REMARK 500 12 GLN A  42       48.82    -79.82                                   
REMARK 500 12 ALA A  43      -71.42    -52.86                                   
REMARK 500 12 PRO A  46        2.33    -53.07                                   
REMARK 500 12 ARG B  50      -55.86   -125.63                                   
REMARK 500 12 GLN B  58      -60.37    -90.97                                   
REMARK 500 12 GLN B  71       35.72    -74.13                                   
REMARK 500 12 GLN B  72     -179.18    -66.87                                   
REMARK 500 12 GLN B  73      -96.46      0.81                                   
REMARK 500 12 PRO B 103       27.20    -72.06                                   
REMARK 500 13 GLN A   3      -10.27     58.69                                   
REMARK 500 13 ASN A  19      -10.44    -49.26                                   
REMARK 500 13 THR A  20      -18.21    120.53                                   
REMARK 500 13 LEU A  44      -17.07   -141.99                                   
REMARK 500 13 ASN B  49      -58.65   -144.23                                   
REMARK 500 13 SER B  69      -72.12    -47.82                                   
REMARK 500 14 GLN A   3      -42.86     64.92                                   
REMARK 500 14 ASN A  19      -11.40    -41.38                                   
REMARK 500 14 THR A  20      -29.61    117.29                                   
REMARK 500 14 ALA A  22      -19.26     55.57                                   
REMARK 500 14 ASN B  49      -52.27   -149.12                                   
REMARK 500 14 SER B  68       -2.20    -51.85                                   
REMARK 500 14 SER B  69      -74.86    -71.89                                   
REMARK 500 14 GLN B  74       -2.55    -52.80                                   
REMARK 500 15 GLN A   3      -28.95     63.39                                   
REMARK 500 15 ASN A  19       -7.84    -56.05                                   
REMARK 500 15 THR A  20      -17.92    115.94                                   
REMARK 500 15 GLN B  58      -60.11    -90.67                                   
REMARK 500 15 GLN B  74       -1.65    -55.54                                   
REMARK 500 15 PRO B 103        1.34    -68.18                                   
REMARK 500 16 GLN A   3      -15.80     45.18                                   
REMARK 500 16 ASN A  19        0.92    -39.73                                   
REMARK 500 16 THR A  20      -25.70    116.70                                   
REMARK 500 16 ALA A  22       -9.58   -140.24                                   
REMARK 500 16 GLN A  42     -128.26   -162.63                                   
REMARK 500 16 ASN B  49      -31.68   -130.80                                   
REMARK 500 16 GLN B  58      -60.02    -91.42                                   
REMARK 500 16 PRO B  70      -10.26     42.13                                   
REMARK 500 16 GLN B  72      -12.64    -43.92                                   
REMARK 500 16 GLN B  74      -14.80    -48.31                                   
REMARK 500 16 GLN B 102       57.68   -143.48                                   
REMARK 500 16 MET B 105      -15.70   -142.92                                   
REMARK 500 17 GLN A   3      -34.99     66.46                                   
REMARK 500 17 SER A  18       30.33   -143.25                                   
REMARK 500 17 THR A  20      -82.07   -154.47                                   
REMARK 500 17 ASN B  49      -58.77   -136.08                                   
REMARK 500 17 SER B  68       39.77    -67.36                                   
REMARK 500 17 SER B  69      -76.69    -87.06                                   
REMARK 500 17 GLN B  71        1.43    -65.87                                   
REMARK 500 17 GLN B  74       -0.86    -54.78                                   
REMARK 500 18 GLN A   3      -31.10     62.78                                   
REMARK 500 18 ASN A  19       -6.81    -53.17                                   
REMARK 500 18 THR A  20      -17.74    116.28                                   
REMARK 500 18 ALA A  22       -2.56   -144.49                                   
REMARK 500 18 ASN B  49      -76.12   -121.18                                   
REMARK 500 18 GLN B  58      -60.41    -90.75                                   
REMARK 500 18 SER B  68       16.95    -55.72                                   
REMARK 500 18 SER B  69      -86.07    -78.08                                   
REMARK 500 18 ASN B 101      -42.12   -146.84                                   
REMARK 500 19 GLN A   3      -49.95     64.50                                   
REMARK 500 19 ASN A  19      -16.98    -41.01                                   
REMARK 500 19 THR A  20      -14.99    120.17                                   
REMARK 500 19 ALA A  22       -0.39   -142.92                                   
REMARK 500 19 ASN B  49      -79.45   -161.70                                   
REMARK 500 20 GLN A   3      -66.56   -143.19                                   
REMARK 500 20 SER A  18       24.20   -143.83                                   
REMARK 500 20 THR A  20      -17.51    124.92                                   
REMARK 500 20 ALA A  22       -8.63   -145.02                                   
REMARK 500 20 PRO A  46       -1.54    -59.19                                   
REMARK 500 20 ASN B  49      -74.15   -156.54                                   
REMARK 500 20 SER B  69      -72.99    -40.85                                   
REMARK 500 20 GLN B  74      -19.05    -48.94                                   
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  1 ARG A   7         0.17    SIDE_CHAIN                              
REMARK 500  1 ARG B  50         0.08    SIDE_CHAIN                              
REMARK 500  2 TYR B  98         0.09    SIDE_CHAIN                              
REMARK 500  5 ARG A   7         0.13    SIDE_CHAIN                              
REMARK 500  7 ARG A   7         0.08    SIDE_CHAIN                              
REMARK 500  9 ARG B  62         0.15    SIDE_CHAIN                              
REMARK 500 11 ARG A  30         0.08    SIDE_CHAIN                              
REMARK 500 12 ARG A   7         0.08    SIDE_CHAIN                              
REMARK 500 13 ARG B  62         0.09    SIDE_CHAIN                              
REMARK 500 14 ARG A  30         0.07    SIDE_CHAIN                              
REMARK 500 15 ARG B  50         0.09    SIDE_CHAIN                              
REMARK 500 16 ARG A   7         0.14    SIDE_CHAIN                              
REMARK 500 17 ARG B  50         0.13    SIDE_CHAIN                              
REMARK 500 17 ARG B  94         0.07    SIDE_CHAIN                              
REMARK 500 18 ARG B  50         0.09    SIDE_CHAIN                              
REMARK 500 18 TYR B  98         0.08    SIDE_CHAIN                              
REMARK 500 20 TYR B  98         0.09    SIDE_CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CHIRAL CENTERS                                             
REMARK 500                                                                      
REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL                     
REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY                      
REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN                            
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE                   
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (11X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16)       
REMARK 500                                                                      
REMARK 500   M RES CSSEQI    IMPROPER   EXPECTED   FOUND DETAILS                
REMARK 500   9 GLN A  40       131.8                     ALPHA-CARBON           
REMARK 500  13 GLN A  40       132.4                     ALPHA-CARBON           
REMARK 500  15 GLN A  40       129.8                     ALPHA-CARBON           
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  1KBH A    1    47  UNP    Q9Y6Q9   NCOA3_HUMAN   1040   1086             
DBREF  1KBH B   48   106  UNP    P45481   CBP_MOUSE     2059   2117             
SEQRES   1 A   47  GLU GLY GLN SER ASP GLU ARG ALA LEU LEU ASP GLN LEU          
SEQRES   2 A   47  HIS THR LEU LEU SER ASN THR ASP ALA THR GLY LEU GLU          
SEQRES   3 A   47  GLU ILE ASP ARG ALA LEU GLY ILE PRO GLU LEU VAL ASN          
SEQRES   4 A   47  GLN GLY GLN ALA LEU GLU PRO LYS                              
SEQRES   1 B   59  PRO ASN ARG SER ILE SER PRO SER ALA LEU GLN ASP LEU          
SEQRES   2 B   59  LEU ARG THR LEU LYS SER PRO SER SER PRO GLN GLN GLN          
SEQRES   3 B   59  GLN GLN VAL LEU ASN ILE LEU LYS SER ASN PRO GLN LEU          
SEQRES   4 B   59  MET ALA ALA PHE ILE LYS GLN ARG THR ALA LYS TYR VAL          
SEQRES   5 B   59  ALA ASN GLN PRO GLY MET GLN                                  
HELIX    1   1 ASP A    5  ASN A   19  1                                  15    
HELIX    2   2 GLY A   24  LEU A   32  1                                   9    
HELIX    3   3 GLY A   33  GLY A   41  1                                   9    
HELIX    4   4 SER B   55  SER B   66  1                                  12    
HELIX    5   5 SER B   69  GLN B   73  5                                   5    
HELIX    6   6 GLN B   74  LYS B   81  1                                   8    
HELIX    7   7 ASN B   83  GLN B  102  1                                  20    
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                         
MODEL        1                                                                  
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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