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Database: PDB
Entry: 5VPC
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Original site: 5VPC 
HEADER    TRANSCRIPTION                           04-MAY-17   5VPC              
TITLE     TRANSCRIPTION FACTOR FOSB/JUND BZIP DOMAIN IN ITS OXIDIZED FORM, TYPE-
TITLE    2 II CRYSTAL                                                           
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: PROTEIN FOSB;                                              
COMPND   3 CHAIN: A, C;                                                         
COMPND   4 FRAGMENT: UNP RESIDUES 153-219;                                      
COMPND   5 SYNONYM: G0/G1 SWITCH REGULATORY PROTEIN 3;                          
COMPND   6 ENGINEERED: YES;                                                     
COMPND   7 MOL_ID: 2;                                                           
COMPND   8 MOLECULE: TRANSCRIPTION FACTOR JUN-D;                                
COMPND   9 CHAIN: B, D;                                                         
COMPND  10 FRAGMENT: UNP RESIDUES 266-332;                                      
COMPND  11 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: FOSB, G0S3;                                                    
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: ROSETTA 2 (DE3);                           
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET21-NESG;                               
SOURCE  11 MOL_ID: 2;                                                           
SOURCE  12 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE  13 ORGANISM_COMMON: HUMAN;                                              
SOURCE  14 ORGANISM_TAXID: 9606;                                                
SOURCE  15 GENE: JUND;                                                          
SOURCE  16 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE  17 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE  18 EXPRESSION_SYSTEM_STRAIN: ROSETTA 2 (DE3);                           
SOURCE  19 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  20 EXPRESSION_SYSTEM_PLASMID: PET21A                                    
KEYWDS    ACTIVATOR PROTEIN-1, BASIC LEUCINE ZIPPER, BZIP, FOS, JUN,            
KEYWDS   2 TRANSCRIPTION FACTOR, DNA-BINDING PROTEIN, REDOX SWITCH, COILED-     
KEYWDS   3 COIL, TRANSCRIPTION                                                  
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    Z.YIN,M.C.MACHIUS,G.RUDENKO                                           
REVDAT   4   11-DEC-19 5VPC    1       REMARK                                   
REVDAT   3   15-NOV-17 5VPC    1       JRNL                                     
REVDAT   2   18-OCT-17 5VPC    1       JRNL                                     
REVDAT   1   06-SEP-17 5VPC    0                                                
JRNL        AUTH   Z.YIN,M.MACHIUS,E.J.NESTLER,G.RUDENKO                        
JRNL        TITL   ACTIVATOR PROTEIN-1: REDOX SWITCH CONTROLLING STRUCTURE AND  
JRNL        TITL 2 DNA-BINDING.                                                 
JRNL        REF    NUCLEIC ACIDS RES.            V.  45 11425 2017              
JRNL        REFN                   ESSN 1362-4962                               
JRNL        PMID   28981703                                                     
JRNL        DOI    10.1093/NAR/GKX795                                           
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.50 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX 1.11.1_2575                                   
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) : 44.04                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.360                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 88.8                           
REMARK   3   NUMBER OF REFLECTIONS             : 14089                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.255                           
REMARK   3   R VALUE            (WORKING SET) : 0.251                           
REMARK   3   FREE R VALUE                     : 0.289                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 9.940                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 1401                            
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 44.0428 -  5.3778    0.97     1458   161  0.2299 0.2200        
REMARK   3     2  5.3778 -  4.2697    1.00     1432   156  0.1986 0.2174        
REMARK   3     3  4.2697 -  3.7303    1.00     1426   157  0.2003 0.2423        
REMARK   3     4  3.7303 -  3.3894    1.00     1430   164  0.2564 0.3236        
REMARK   3     5  3.3894 -  3.1465    1.00     1438   156  0.2956 0.3492        
REMARK   3     6  3.1465 -  2.9610    1.00     1418   153  0.2988 0.3658        
REMARK   3     7  2.9610 -  2.8128    1.00     1425   155  0.3267 0.3816        
REMARK   3     8  2.8128 -  2.6903    0.87     1239   134  0.3076 0.3994        
REMARK   3     9  2.6903 -  2.5868    0.63      879   102  0.3011 0.3403        
REMARK   3    10  2.5868 -  2.4975    0.39      543    63  0.3023 0.3466        
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)     : 0.390            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 32.220           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 34.75                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 63.48                          
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      :  0.003           1910                                  
REMARK   3   ANGLE     :  0.508           2548                                  
REMARK   3   CHIRALITY :  0.026            305                                  
REMARK   3   PLANARITY :  0.002            330                                  
REMARK   3   DIHEDRAL  : 10.864           1256                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 6                                          
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 163 THROUGH 177 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 177.1736  30.7211  87.5312              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6991 T22:   0.5937                                     
REMARK   3      T33:   0.7570 T12:  -0.0147                                     
REMARK   3      T13:  -0.0620 T23:  -0.0322                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.2382 L22:   3.5134                                     
REMARK   3      L33:   7.1108 L12:   2.3330                                     
REMARK   3      L13:  -0.2575 L23:   0.7502                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.6830 S12:  -0.4393 S13:  -0.0039                       
REMARK   3      S21:   0.1675 S22:  -0.0429 S23:   0.1211                       
REMARK   3      S31:  -0.4287 S32:  -0.0952 S33:   1.4986                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 178 THROUGH 217 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 175.4464  36.6173 123.9571              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3751 T22:   0.1610                                     
REMARK   3      T33:   0.1154 T12:  -0.1288                                     
REMARK   3      T13:   0.0597 T23:   0.0021                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.4442 L22:   1.5542                                     
REMARK   3      L33:   8.8529 L12:   1.0293                                     
REMARK   3      L13:   2.9943 L23:   3.4784                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1797 S12:   0.0519 S13:   0.0725                       
REMARK   3      S21:  -0.1853 S22:   0.0606 S23:   0.0182                       
REMARK   3      S31:  -1.1178 S32:  -0.0888 S33:  -0.6642                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 266 THROUGH 332 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 178.4461  27.2104 107.9613              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2776 T22:   0.2104                                     
REMARK   3      T33:   0.0470 T12:  -0.1047                                     
REMARK   3      T13:  -0.0196 T23:  -0.0745                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.2112 L22:   0.1863                                     
REMARK   3      L33:   2.8503 L12:  -0.1086                                     
REMARK   3      L13:  -0.5280 L23:   0.6651                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0254 S12:  -0.0308 S13:   0.0263                       
REMARK   3      S21:  -0.1582 S22:   0.1951 S23:  -0.0143                       
REMARK   3      S31:  -0.3205 S32:   0.3700 S33:  -0.3497                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 163 THROUGH 178 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 167.4645  37.6272 103.1068              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3967 T22:   0.7073                                     
REMARK   3      T33:   0.6402 T12:  -0.1633                                     
REMARK   3      T13:   0.0268 T23:  -0.2667                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.5927 L22:   5.9515                                     
REMARK   3      L33:   4.7657 L12:   0.9426                                     
REMARK   3      L13:  -0.5149 L23:  -4.1056                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3360 S12:   1.7441 S13:  -0.8432                       
REMARK   3      S21:  -0.9998 S22:   0.5747 S23:   0.4483                       
REMARK   3      S31:   0.5937 S32:   0.0613 S33:  -0.0705                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: CHAIN 'C' AND (RESID 179 THROUGH 218 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 201.0989  31.2504  85.3410              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2978 T22:   0.1992                                     
REMARK   3      T33:   0.4326 T12:  -0.0281                                     
REMARK   3      T13:   0.2188 T23:   0.0002                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.6295 L22:   0.2108                                     
REMARK   3      L33:   0.8765 L12:   0.1798                                     
REMARK   3      L13:  -0.1074 L23:  -0.4291                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.5259 S12:  -0.1129 S13:  -1.3332                       
REMARK   3      S21:   0.1892 S22:   0.0038 S23:   0.3509                       
REMARK   3      S31:   0.4181 S32:  -0.0503 S33:   0.1130                       
REMARK   3   TLS GROUP : 6                                                      
REMARK   3    SELECTION: CHAIN 'D' AND (RESID 270 THROUGH 332 )                 
REMARK   3    ORIGIN FOR THE GROUP (A): 190.7130  40.6011  92.3832              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1126 T22:   0.1564                                     
REMARK   3      T33:   0.2576 T12:  -0.0611                                     
REMARK   3      T13:   0.0964 T23:  -0.0659                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.4999 L22:   0.4793                                     
REMARK   3      L33:   0.5314 L12:  -0.4962                                     
REMARK   3      L13:  -0.4534 L23:   0.4669                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1973 S12:   0.1505 S13:  -0.3824                       
REMARK   3      S21:   0.0612 S22:   0.0023 S23:   0.2267                       
REMARK   3      S31:   0.0518 S32:  -0.2470 S33:   0.2175                       
REMARK   3                                                                      
REMARK   3  NCS DETAILS                                                         
REMARK   3   NUMBER OF NCS GROUPS : 2                                           
REMARK   3   NCS GROUP : 1                                                      
REMARK   3    NCS OPERATOR : 1                                                  
REMARK   3     REFERENCE SELECTION: (CHAIN A AND (RESID 163 THROUGH 174 OR      
REMARK   3                          (RESID 175 AND (NAME N OR NAME CA OR NAME   
REMARK   3                          C OR NAME O OR NAME CB )) OR RESID 176      
REMARK   3                          THROUGH 177 OR (RESID 178 AND (NAME N OR    
REMARK   3                          NAME CA OR NAME C OR NAME O OR NAME CB ))   
REMARK   3                          OR RESID 179 THROUGH 217))                  
REMARK   3     SELECTION          : (CHAIN C AND RESID 163 THROUGH 217)         
REMARK   3     ATOM PAIRS NUMBER  : 597                                         
REMARK   3     RMSD               : NULL                                        
REMARK   3   NCS GROUP : 2                                                      
REMARK   3    NCS OPERATOR : 1                                                  
REMARK   3     REFERENCE SELECTION: (CHAIN B AND (RESID 270 OR (RESID 271 AND   
REMARK   3                          (NAME N OR NAME CA OR NAME C OR NAME O ))   
REMARK   3                          OR (RESID 272 THROUGH 273 AND (NAME N OR    
REMARK   3                          NAME CA OR NAME C OR NAME O OR NAME CB ))   
REMARK   3                          OR RESID 274 OR (RESID 275 AND (NAME N OR   
REMARK   3                          NAME CA OR NAME C OR NAME O OR NAME CB OR   
REMARK   3                          NAME CG )) OR RESID 276 OR (RESID 277 AND   
REMARK   3                          (NAME N OR NAME CA OR NAME C OR NAME O OR   
REMARK   3                          NAME CB )) OR RESID 278 THROUGH 287 OR      
REMARK   3                          (RESID 288 AND (NAME N OR NAME CA OR NAME   
REMARK   3                          C OR NAME O OR NAME CB )) OR RESID 289      
REMARK   3                          THROUGH 332))                               
REMARK   3     SELECTION          : CHAIN D                                     
REMARK   3     ATOM PAIRS NUMBER  : 724                                         
REMARK   3     RMSD               : NULL                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 5VPC COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 05-MAY-17.                  
REMARK 100 THE DEPOSITION ID IS D_1000227768.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 22-OCT-16                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 7.0                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : APS                                
REMARK 200  BEAMLINE                       : 21-ID-F                            
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.9787                             
REMARK 200  MONOCHROMATOR                  : DIAMOND [111]                      
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : MARMOSAIC 225 MM CCD               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : DENZO                              
REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 15500                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.498                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 44.040                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.7                               
REMARK 200  DATA REDUNDANCY                : 3.800                              
REMARK 200  R MERGE                    (I) : 0.07100                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 17.0000                            
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     (%) : 100.0                              
REMARK 200  DATA REDUNDANCY IN SHELL       : 3.80                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.58200                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 2.200                              
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: 5VPA                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 64.88                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.50                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 12% (V/V) ETHANOL, 0.3 M NACL AND 2%     
REMARK 280  (V/V) JEFFAMINE M-600, PH 7.0, VAPOR DIFFUSION, HANGING DROP,       
REMARK 280  TEMPERATURE 293K                                                    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1                          
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,Y,-Z                                                 
REMARK 290       3555   X+1/2,Y+1/2,Z                                           
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        0.00000            
REMARK 290   SMTRY2   2  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1   3  1.000000  0.000000  0.000000       55.58850            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       24.97450            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000       55.58850            
REMARK 290   SMTRY2   4  0.000000  1.000000  0.000000       24.97450            
REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1, 2                                                    
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: 3510 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 9760 ANGSTROM**2                        
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -74.0 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 350                                                                      
REMARK 350 BIOMOLECULE: 2                                                       
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: 2610 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 9070 ANGSTROM**2                        
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -28.0 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, D                                  
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     SER A   152                                                      
REMARK 465     GLU A   153                                                      
REMARK 465     GLU A   154                                                      
REMARK 465     GLU A   155                                                      
REMARK 465     GLU A   156                                                      
REMARK 465     LYS A   157                                                      
REMARK 465     ARG A   158                                                      
REMARK 465     ARG A   159                                                      
REMARK 465     VAL A   160                                                      
REMARK 465     ARG A   161                                                      
REMARK 465     ARG A   162                                                      
REMARK 465     HIS A   218                                                      
REMARK 465     LYS A   219                                                      
REMARK 465     SER C   152                                                      
REMARK 465     GLU C   153                                                      
REMARK 465     GLU C   154                                                      
REMARK 465     GLU C   155                                                      
REMARK 465     GLU C   156                                                      
REMARK 465     LYS C   157                                                      
REMARK 465     ARG C   158                                                      
REMARK 465     ARG C   159                                                      
REMARK 465     VAL C   160                                                      
REMARK 465     ARG C   161                                                      
REMARK 465     LYS C   219                                                      
REMARK 465     SER D   265                                                      
REMARK 465     GLN D   266                                                      
REMARK 465     GLU D   267                                                      
REMARK 465     ARG D   268                                                      
REMARK 465     ILE D   269                                                      
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     GLU A 163    CG   CD   OE1  OE2                                  
REMARK 470     ARG A 164    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     LYS A 166    CG   CD   CE   NZ                                   
REMARK 470     LYS A 206    CG   CD   CE   NZ                                   
REMARK 470     SER B 265    OG                                                  
REMARK 470     LYS B 270    CG   CD   CE   NZ                                   
REMARK 470     GLU B 298    CG   CD   OE1  OE2                                  
REMARK 470     ARG C 162    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     GLU C 163    CG   CD   OE1  OE2                                  
REMARK 470     ARG C 164    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     LYS C 166    CG   CD   CE   NZ                                   
REMARK 470     ARG C 175    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     GLU C 178    CG   CD   OE1  OE2                                  
REMARK 470     LYS C 206    CG   CD   CE   NZ                                   
REMARK 470     LYS D 270    CG   CD   CE   NZ                                   
REMARK 470     ALA D 271    CB                                                  
REMARK 470     GLU D 272    CG   CD   OE1  OE2                                  
REMARK 470     ARG D 273    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     ARG D 275    CD   NE   CZ   NH1  NH2                             
REMARK 470     ARG D 277    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     ARG D 288    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     GLU D 298    CG   CD   OE1  OE2                                  
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   OE2  GLU B   297     HZ1  LYS B   325     4948     1.48            
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    GLN B 266      -41.46   -144.36                                   
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                              NA A 301  NA                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 GLU A 200   OE1                                                    
REMARK 620 2 HOH B 515   O   146.4                                              
REMARK 620 N                    1                                               
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 301                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 302                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue NA B 401                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 402                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 403                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 404                  
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 5VPA   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5VPD   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5VPE   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5VPF   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 5VPB   RELATED DB: PDB                                   
DBREF  5VPC A  153   219  UNP    P53539   FOSB_HUMAN     153    219             
DBREF  5VPC B  266   332  UNP    P17535   JUND_HUMAN     266    332             
DBREF  5VPC C  153   219  UNP    P53539   FOSB_HUMAN     153    219             
DBREF  5VPC D  266   332  UNP    P17535   JUND_HUMAN     266    332             
SEQADV 5VPC SER A  152  UNP  P53539              EXPRESSION TAG                 
SEQADV 5VPC SER B  265  UNP  P17535              EXPRESSION TAG                 
SEQADV 5VPC SER C  152  UNP  P53539              EXPRESSION TAG                 
SEQADV 5VPC SER D  265  UNP  P17535              EXPRESSION TAG                 
SEQRES   1 A   68  SER GLU GLU GLU GLU LYS ARG ARG VAL ARG ARG GLU ARG          
SEQRES   2 A   68  ASN LYS LEU ALA ALA ALA LYS CYS ARG ASN ARG ARG ARG          
SEQRES   3 A   68  GLU LEU THR ASP ARG LEU GLN ALA GLU THR ASP GLN LEU          
SEQRES   4 A   68  GLU GLU GLU LYS ALA GLU LEU GLU SER GLU ILE ALA GLU          
SEQRES   5 A   68  LEU GLN LYS GLU LYS GLU ARG LEU GLU PHE VAL LEU VAL          
SEQRES   6 A   68  ALA HIS LYS                                                  
SEQRES   1 B   68  SER GLN GLU ARG ILE LYS ALA GLU ARG LYS ARG LEU ARG          
SEQRES   2 B   68  ASN ARG ILE ALA ALA SER LYS CYS ARG LYS ARG LYS LEU          
SEQRES   3 B   68  GLU ARG ILE SER ARG LEU GLU GLU LYS VAL LYS THR LEU          
SEQRES   4 B   68  LYS SER GLN ASN THR GLU LEU ALA SER THR ALA SER LEU          
SEQRES   5 B   68  LEU ARG GLU GLN VAL ALA GLN LEU LYS GLN LYS VAL LEU          
SEQRES   6 B   68  SER HIS VAL                                                  
SEQRES   1 C   68  SER GLU GLU GLU GLU LYS ARG ARG VAL ARG ARG GLU ARG          
SEQRES   2 C   68  ASN LYS LEU ALA ALA ALA LYS CYS ARG ASN ARG ARG ARG          
SEQRES   3 C   68  GLU LEU THR ASP ARG LEU GLN ALA GLU THR ASP GLN LEU          
SEQRES   4 C   68  GLU GLU GLU LYS ALA GLU LEU GLU SER GLU ILE ALA GLU          
SEQRES   5 C   68  LEU GLN LYS GLU LYS GLU ARG LEU GLU PHE VAL LEU VAL          
SEQRES   6 C   68  ALA HIS LYS                                                  
SEQRES   1 D   68  SER GLN GLU ARG ILE LYS ALA GLU ARG LYS ARG LEU ARG          
SEQRES   2 D   68  ASN ARG ILE ALA ALA SER LYS CYS ARG LYS ARG LYS LEU          
SEQRES   3 D   68  GLU ARG ILE SER ARG LEU GLU GLU LYS VAL LYS THR LEU          
SEQRES   4 D   68  LYS SER GLN ASN THR GLU LEU ALA SER THR ALA SER LEU          
SEQRES   5 D   68  LEU ARG GLU GLN VAL ALA GLN LEU LYS GLN LYS VAL LEU          
SEQRES   6 D   68  SER HIS VAL                                                  
HET     NA  A 301       1                                                       
HET     NA  A 302       1                                                       
HET     NA  B 401       1                                                       
HET     CL  B 402       1                                                       
HET     CL  B 403       1                                                       
HET     CL  B 404       1                                                       
HETNAM      NA SODIUM ION                                                       
HETNAM      CL CHLORIDE ION                                                     
FORMUL   5   NA    3(NA 1+)                                                     
FORMUL   8   CL    3(CL 1-)                                                     
FORMUL  11  HOH   *29(H2 O)                                                     
HELIX    1 AA1 GLU A  163  ARG A  175  1                                  13    
HELIX    2 AA2 ARG A  177  VAL A  216  1                                  40    
HELIX    3 AA3 GLN B  266  HIS B  331  1                                  66    
HELIX    4 AA4 GLU C  163  ARG C  175  1                                  13    
HELIX    5 AA5 ARG C  177  HIS C  218  1                                  42    
HELIX    6 AA6 ALA D  271  HIS D  331  1                                  61    
SSBOND   1 CYS A  172    CYS B  285                          1555   1555  2.03  
SSBOND   2 CYS C  172    CYS D  285                          1555   1555  2.03  
LINK         OE1 GLU A 200                NA    NA A 301     1555   1555  2.92  
LINK        NA    NA A 301                 O   HOH B 515     1555   1555  2.71  
SITE     1 AC1  3 GLU A 200  ARG B 318  HOH B 515                               
SITE     1 AC2  2 ALA A 195  GLU A 198                                          
SITE     1 AC3  2 ARG B 318  GLU B 319                                          
SITE     1 AC4  1 HOH B 507                                                     
SITE     1 AC5  3 ARG A 173  LYS B 289  ARG B 292                               
SITE     1 AC6  1 ARG B 279                                                     
CRYST1  111.177   49.949   97.746  90.00 122.94  90.00 C 1 2 1       8          
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      0.008995  0.000000  0.005828        0.00000                         
SCALE2      0.000000  0.020020  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.012190        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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