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Database: PDB
Entry: 3QBZ
LinkDB: 3QBZ
Original site: 3QBZ 
HEADER    CELL CYCLE                              14-JAN-11   3QBZ              
TITLE     CRYSTAL STRUCTURE OF THE RAD53-RECOGNITION DOMAIN OF SACCHAROMYCES    
TITLE    2 CEREVISIAE DBF4                                                      
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: DDK KINASE REGULATORY SUBUNIT DBF4;                        
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: RESIDUES 66-221, HBRCT DOMAIN;                             
COMPND   5 SYNONYM: DUMBBELL FORMING PROTEIN 4;                                 
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
SOURCE   3 ORGANISM_COMMON: BREWER'S YEAST,LAGER BEER YEAST,YEAST;              
SOURCE   4 ORGANISM_TAXID: 4932;                                                
SOURCE   5 GENE: D4205, DBF4, DNA52, YD9609.07C, YDR052C;                       
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 DE3 STAR PRAREPLYSS;                  
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
KEYWDS    FHA DOMAIN,RAD53, REPLICATION CHECKPOINT, CELL CYCLE                  
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    L.A.MATTHEWS,D.R.JONES,A.A.PRASAD,B.P.DUNCKER,A.GUARNE                
REVDAT   3   20-FEB-13 3QBZ    1       JRNL                                     
REVDAT   2   21-DEC-11 3QBZ    1       JRNL                                     
REVDAT   1   07-DEC-11 3QBZ    0                                                
JRNL        AUTH   L.A.MATTHEWS,D.R.JONES,A.A.PRASAD,B.P.DUNCKER,A.GUARNE       
JRNL        TITL   SACCHAROMYCES CEREVISIAE DBF4 HAS UNIQUE FOLD NECESSARY FOR  
JRNL        TITL 2 INTERACTION WITH RAD53 KINASE.                               
JRNL        REF    J.BIOL.CHEM.                  V. 287  2378 2012              
JRNL        REFN                   ISSN 0021-9258                               
JRNL        PMID   22130670                                                     
JRNL        DOI    10.1074/JBC.M111.233973                                      
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   L.A.MATTHEWS,A.DUONG,A.A.PRASAD,B.P.DUNCKER,A.GUARNE         
REMARK   1  TITL   CRYSTALLIZATION AND PRELIMINARY X-RAY DIFFRACTION ANALYSIS   
REMARK   1  TITL 2 OF MOTIF N FROM SACCHAROMYCES CEREVISIAE DBF4                
REMARK   1  REF    ACTA CRYSTALLOGR.,SECT.F      V. F65   890 2009              
REMARK   1  REFN                   ESSN 1744-3091                               
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.69 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX (PHENIX.REFINE: 1.6.4_486)                    
REMARK   3   AUTHORS     : PAUL ADAMS,PAVEL AFONINE,VICENT CHEN,IAN             
REMARK   3               : DAVIS,KRESHNA GOPAL,RALF GROSSE-                     
REMARK   3               : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO,              
REMARK   3               : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL            
REMARK   3               : MORIARTY,REETAL PAI,RANDY READ,JANE                  
REMARK   3               : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM             
REMARK   3               : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH,             
REMARK   3               : LAURENT STORONI,TOM TERWILLIGER,PETER                
REMARK   3               : ZWART                                                
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : MLHL                                          
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.69                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 38.82                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 0.000                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 99.8                           
REMARK   3   NUMBER OF REFLECTIONS             : 6361                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.226                           
REMARK   3   R VALUE            (WORKING SET) : 0.224                           
REMARK   3   FREE R VALUE                     : 0.273                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 4.720                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 300                             
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 38.8272 -  3.3918    1.00     3133   148  0.2121 0.2472        
REMARK   3     2  3.3918 -  2.6923    1.00     2928   152  0.2575 0.3418        
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED        : FLAT BULK SOLVENT MODEL                       
REMARK   3   SOLVENT RADIUS     : 1.10                                          
REMARK   3   SHRINKAGE RADIUS   : 0.83                                          
REMARK   3   K_SOL              : 0.32                                          
REMARK   3   B_SOL              : 42.73                                         
REMARK   3                                                                      
REMARK   3  ERROR ESTIMATES.                                                    
REMARK   3   COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED)     : 0.430            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : NULL             
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 53.46                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : 7.76730                                              
REMARK   3    B22 (A**2) : 7.76730                                              
REMARK   3    B33 (A**2) : -15.53450                                            
REMARK   3    B12 (A**2) : -0.00000                                             
REMARK   3    B13 (A**2) : -0.00000                                             
REMARK   3    B23 (A**2) : -0.00000                                             
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      :  0.008           1074                                  
REMARK   3   ANGLE     :  1.034           1449                                  
REMARK   3   CHIRALITY :  0.068            161                                  
REMARK   3   PLANARITY :  0.004            178                                  
REMARK   3   DIHEDRAL  : 16.070            412                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 10                                         
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: chain A and resid 98:109                               
REMARK   3    ORIGIN FOR THE GROUP (A): -21.3364  18.9067  19.2130              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4678 T22:   0.2152                                     
REMARK   3      T33:   0.3920 T12:  -0.1353                                     
REMARK   3      T13:  -0.0525 T23:  -0.0925                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9308 L22:   0.8821                                     
REMARK   3      L33:   3.5740 L12:   0.1381                                     
REMARK   3      L13:  -0.3684 L23:  -1.5007                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0168 S12:   0.1132 S13:   0.1651                       
REMARK   3      S21:  -1.3666 S22:   0.3953 S23:   0.4425                       
REMARK   3      S31:   0.8596 S32:   0.0376 S33:  -0.1696                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: chain A and resid 110:132                              
REMARK   3    ORIGIN FOR THE GROUP (A): -27.5838  -5.6491  20.8475              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4928 T22:   0.2011                                     
REMARK   3      T33:   0.2101 T12:  -0.1595                                     
REMARK   3      T13:  -0.0776 T23:   0.0367                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.8316 L22:   0.1219                                     
REMARK   3      L33:   1.1129 L12:  -0.2710                                     
REMARK   3      L13:   0.0579 L23:   0.2222                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0993 S12:  -0.0860 S13:  -0.2814                       
REMARK   3      S21:   0.2220 S22:  -0.1800 S23:  -0.0802                       
REMARK   3      S31:   0.3033 S32:   0.1132 S33:   0.0643                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: chain A and resid 133:138                              
REMARK   3    ORIGIN FOR THE GROUP (A): -34.6185 -15.9327  -3.8087              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.8395 T22:   0.3363                                     
REMARK   3      T33:   0.3690 T12:   0.1592                                     
REMARK   3      T13:  -0.1542 T23:  -0.1277                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.8636 L22:   4.6720                                     
REMARK   3      L33:   6.3800 L12:  -1.7303                                     
REMARK   3      L13:  -5.0527 L23:   4.1137                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -1.6864 S12:   0.2567 S13:   0.9042                       
REMARK   3      S21:   1.5486 S22:   0.9564 S23:  -1.0096                       
REMARK   3      S31:   1.4584 S32:  -0.5129 S33:   0.5822                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: chain A and resid 139:149                              
REMARK   3    ORIGIN FOR THE GROUP (A): -25.7734 -13.7309   1.1740              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5181 T22:   0.4015                                     
REMARK   3      T33:   0.3961 T12:   0.1176                                     
REMARK   3      T13:   0.0772 T23:   0.0469                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.4966 L22:   3.2303                                     
REMARK   3      L33:   5.9320 L12:  -1.8555                                     
REMARK   3      L13:   0.6618 L23:   1.2185                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2415 S12:   0.3853 S13:  -0.5756                       
REMARK   3      S21:   0.4407 S22:  -0.2533 S23:  -0.1422                       
REMARK   3      S31:   0.3101 S32:   1.0932 S33:   0.3992                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: chain A and resid 150:166                              
REMARK   3    ORIGIN FOR THE GROUP (A): -25.1499 -13.4297  16.8780              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5833 T22:   0.4116                                     
REMARK   3      T33:   0.1656 T12:  -0.1332                                     
REMARK   3      T13:  -0.1323 T23:   0.0166                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9404 L22:   2.3719                                     
REMARK   3      L33:   0.4289 L12:   0.1215                                     
REMARK   3      L13:  -0.6136 L23:  -1.0705                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0305 S12:   0.4071 S13:  -0.3660                       
REMARK   3      S21:  -0.0715 S22:   0.0479 S23:  -0.5066                       
REMARK   3      S31:   0.9371 S32:   0.2136 S33:  -0.1239                       
REMARK   3   TLS GROUP : 6                                                      
REMARK   3    SELECTION: chain A and resid 167:179                              
REMARK   3    ORIGIN FOR THE GROUP (A): -36.2030 -11.9279  14.7589              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4459 T22:   0.0973                                     
REMARK   3      T33:   0.1997 T12:  -0.1241                                     
REMARK   3      T13:  -0.0330 T23:   0.0559                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9000 L22:   0.1240                                     
REMARK   3      L33:   1.2021 L12:   0.0280                                     
REMARK   3      L13:   0.7768 L23:   0.1346                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1894 S12:   0.1900 S13:  -0.2168                       
REMARK   3      S21:   0.0321 S22:   0.3388 S23:  -0.1422                       
REMARK   3      S31:  -0.1997 S32:   0.6653 S33:  -0.0162                       
REMARK   3   TLS GROUP : 7                                                      
REMARK   3    SELECTION: chain A and resid 180:189                              
REMARK   3    ORIGIN FOR THE GROUP (A): -47.7855 -12.4268  10.4345              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5304 T22:   0.2079                                     
REMARK   3      T33:   0.2724 T12:  -0.0839                                     
REMARK   3      T13:   0.0831 T23:   0.0056                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.4370 L22:   7.3273                                     
REMARK   3      L33:   1.9328 L12:   1.6546                                     
REMARK   3      L13:  -0.7031 L23:  -3.6646                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   1.0081 S12:  -0.1181 S13:   0.1902                       
REMARK   3      S21:  -1.2217 S22:  -0.7497 S23:   0.9922                       
REMARK   3      S31:  -0.3165 S32:   0.6820 S33:  -0.2781                       
REMARK   3   TLS GROUP : 8                                                      
REMARK   3    SELECTION: chain A and resid 190:199                              
REMARK   3    ORIGIN FOR THE GROUP (A): -43.2594 -11.9509  18.9753              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.5649 T22:   0.0651                                     
REMARK   3      T33:   0.2407 T12:  -0.1623                                     
REMARK   3      T13:   0.0229 T23:  -0.0237                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.2127 L22:   0.2054                                     
REMARK   3      L33:   0.8870 L12:  -0.3401                                     
REMARK   3      L13:   0.1584 L23:  -0.4623                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0328 S12:   0.0008 S13:  -0.0368                       
REMARK   3      S21:   0.6210 S22:  -0.1672 S23:   0.2570                       
REMARK   3      S31:  -0.1084 S32:   0.2994 S33:  -0.0867                       
REMARK   3   TLS GROUP : 9                                                      
REMARK   3    SELECTION: chain A and resid 200:213                              
REMARK   3    ORIGIN FOR THE GROUP (A): -29.8266  -2.5978  11.9125              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4608 T22:   0.2511                                     
REMARK   3      T33:   0.3119 T12:  -0.1452                                     
REMARK   3      T13:  -0.0327 T23:   0.0301                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.5759 L22:   1.7480                                     
REMARK   3      L33:   1.2460 L12:   0.0534                                     
REMARK   3      L13:  -1.0320 L23:   0.0994                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2370 S12:  -0.0321 S13:   0.4755                       
REMARK   3      S21:  -0.1697 S22:   0.1637 S23:   0.5563                       
REMARK   3      S31:  -0.0683 S32:  -0.0843 S33:   0.0623                       
REMARK   3   TLS GROUP : 10                                                     
REMARK   3    SELECTION: chain A and resid 214:219                              
REMARK   3    ORIGIN FOR THE GROUP (A): -17.9068  -1.3348  11.5798              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.6811 T22:   0.5084                                     
REMARK   3      T33:   0.2314 T12:  -0.1972                                     
REMARK   3      T13:  -0.1289 T23:  -0.1682                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.2786 L22:   4.6007                                     
REMARK   3      L33:   6.6624 L12:  -3.3780                                     
REMARK   3      L13:  -2.6818 L23:   1.2019                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.7344 S12:   0.6123 S13:   0.4261                       
REMARK   3      S21:  -1.0235 S22:   0.6263 S23:  -0.5858                       
REMARK   3      S31:   0.4878 S32:   0.7780 S33:  -1.3690                       
REMARK   3                                                                      
REMARK   3  NCS DETAILS                                                         
REMARK   3   NUMBER OF NCS GROUPS : NULL                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 3QBZ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-FEB-11.                  
REMARK 100 THE RCSB ID CODE IS RCSB063452.                                      
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 10-NOV-10                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : NSLS                               
REMARK 200  BEAMLINE                       : X25                                
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 1.1                                
REMARK 200  MONOCHROMATOR                  : SI(111)                            
REMARK 200  OPTICS                         : MIRRORS                            
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : ADSC QUANTUM 315                   
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : HKL-2000                           
REMARK 200  DATA SCALING SOFTWARE          : HKL-2000                           
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 6371                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.690                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 50.000                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : 0.000                              
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.7                               
REMARK 200  DATA REDUNDANCY                : 6.900                              
REMARK 200  R MERGE                    (I) : 0.05700                            
REMARK 200  R SYM                      (I) : 0.04200                            
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 31.0000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.69                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.74                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 99.7                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 6.20                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.41900                            
REMARK 200  R SYM FOR SHELL            (I) : 0.34400                            
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 3.500                              
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: PDB ENTRY 3OQ4                                       
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 55.47                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.76                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 1.9 M AMMONIUM SULFATE   50 MM SODIUM    
REMARK 280  CACODYLATE 15 MM CYMAL-7, PH 6.5, VAPOR DIFFUSION, HANGING DROP,    
REMARK 280  TEMPERATURE 277K                                                    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 64 2 2                         
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -Y,X-Y,Z+1/3                                            
REMARK 290       3555   -X+Y,-X,Z+2/3                                           
REMARK 290       4555   -X,-Y,Z                                                 
REMARK 290       5555   Y,-X+Y,Z+1/3                                            
REMARK 290       6555   X-Y,X,Z+2/3                                             
REMARK 290       7555   Y,X,-Z+1/3                                              
REMARK 290       8555   X-Y,-Y,-Z                                               
REMARK 290       9555   -X,-X+Y,-Z+2/3                                          
REMARK 290      10555   -Y,-X,-Z+1/3                                            
REMARK 290      11555   -X+Y,Y,-Z                                               
REMARK 290      12555   X,X-Y,-Z+2/3                                            
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 -0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       34.55633            
REMARK 290   SMTRY1   3 -0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   3 -0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000       69.11267            
REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   4  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   5  0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   5 -0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   5  0.000000  0.000000  1.000000       34.55633            
REMARK 290   SMTRY1   6  0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   6  0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   6  0.000000  0.000000  1.000000       69.11267            
REMARK 290   SMTRY1   7 -0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   7  0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   7  0.000000  0.000000 -1.000000       34.55633            
REMARK 290   SMTRY1   8  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   8  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   8  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1   9 -0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   9 -0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   9  0.000000  0.000000 -1.000000       69.11267            
REMARK 290   SMTRY1  10  0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2  10 -0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3  10  0.000000  0.000000 -1.000000       34.55633            
REMARK 290   SMTRY1  11 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2  11  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3  11  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1  12  0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2  12  0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3  12  0.000000  0.000000 -1.000000       69.11267            
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: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 2                                                       
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 2890 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 15880 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -82.0 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350   BIOMT1   2  0.500000 -0.866025  0.000000        0.00000            
REMARK 350   BIOMT2   2 -0.866025 -0.500000  0.000000        0.00000            
REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000       34.55633            
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     GLY A    62                                                      
REMARK 465     SER A    63                                                      
REMARK 465     HIS A    64                                                      
REMARK 465     MET A    65                                                      
REMARK 465     GLN A    66                                                      
REMARK 465     GLN A    67                                                      
REMARK 465     GLN A    68                                                      
REMARK 465     GLN A    69                                                      
REMARK 465     HIS A    70                                                      
REMARK 465     LEU A    71                                                      
REMARK 465     HIS A    72                                                      
REMARK 465     GLU A    73                                                      
REMARK 465     LYS A    74                                                      
REMARK 465     LYS A    75                                                      
REMARK 465     ARG A    76                                                      
REMARK 465     ALA A    77                                                      
REMARK 465     ARG A    78                                                      
REMARK 465     ILE A    79                                                      
REMARK 465     GLU A    80                                                      
REMARK 465     ARG A    81                                                      
REMARK 465     ALA A    82                                                      
REMARK 465     ARG A    83                                                      
REMARK 465     SER A    84                                                      
REMARK 465     ILE A    85                                                      
REMARK 465     GLU A    86                                                      
REMARK 465     GLY A    87                                                      
REMARK 465     ALA A    88                                                      
REMARK 465     VAL A    89                                                      
REMARK 465     GLN A    90                                                      
REMARK 465     VAL A    91                                                      
REMARK 465     SER A    92                                                      
REMARK 465     LYS A    93                                                      
REMARK 465     GLY A    94                                                      
REMARK 465     THR A    95                                                      
REMARK 465     GLY A    96                                                      
REMARK 465     LEU A    97                                                      
REMARK 465     LEU A   221                                                      
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     LYS A  98    CG   CD   CE   NZ                                   
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 1                   
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 2                   
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 3                   
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 3OQ0   RELATED DB: PDB                                   
REMARK 900 STRUCTURE OF 6XHIS DBF4 FRAGMENT ENCOMPASSING RESIDUES 120-          
REMARK 900 250                                                                  
REMARK 900 RELATED ID: 3OQ4   RELATED DB: PDB                                   
REMARK 900 STRUCTURE OF DBF4 FRAGMENT ENCOMPASSING RESIDUES 120-250             
REMARK 900 (HIS-TAG REMOVED)                                                    
DBREF  3QBZ A   66   221  UNP    P32325   DBF4_YEAST      66    221             
SEQADV 3QBZ GLY A   62  UNP  P32325              EXPRESSION TAG                 
SEQADV 3QBZ SER A   63  UNP  P32325              EXPRESSION TAG                 
SEQADV 3QBZ HIS A   64  UNP  P32325              EXPRESSION TAG                 
SEQADV 3QBZ MET A   65  UNP  P32325              EXPRESSION TAG                 
SEQRES   1 A  160  GLY SER HIS MET GLN GLN GLN GLN HIS LEU HIS GLU LYS          
SEQRES   2 A  160  LYS ARG ALA ARG ILE GLU ARG ALA ARG SER ILE GLU GLY          
SEQRES   3 A  160  ALA VAL GLN VAL SER LYS GLY THR GLY LEU LYS ASN VAL          
SEQRES   4 A  160  GLU PRO ARG VAL THR PRO LYS GLU LEU LEU GLU TRP GLN          
SEQRES   5 A  160  THR ASN TRP LYS LYS ILE MET LYS ARG ASP SER ARG ILE          
SEQRES   6 A  160  TYR PHE ASP ILE THR ASP ASP VAL GLU MET ASN THR TYR          
SEQRES   7 A  160  ASN LYS SER LYS MET ASP LYS ARG ARG ASP LEU LEU LYS          
SEQRES   8 A  160  ARG GLY PHE LEU THR LEU GLY ALA GLN ILE THR GLN PHE          
SEQRES   9 A  160  PHE ASP THR THR VAL THR ILE VAL ILE THR ARG ARG SER          
SEQRES  10 A  160  VAL GLU ASN ILE TYR LEU LEU LYS ASP THR ASP ILE LEU          
SEQRES  11 A  160  SER ARG ALA LYS LYS ASN TYR MET LYS VAL TRP SER TYR          
SEQRES  12 A  160  GLU LYS ALA ALA ARG PHE LEU LYS ASN LEU ASP VAL ASP          
SEQRES  13 A  160  LEU ASP HIS LEU                                              
HET    SO4  A   1       5                                                       
HET    SO4  A   2       5                                                       
HET    SO4  A   3       5                                                       
HETNAM     SO4 SULFATE ION                                                      
FORMUL   2  SO4    3(O4 S 2-)                                                   
FORMUL   5  HOH   *10(H2 O)                                                     
HELIX    1   1 THR A  105  SER A  124  1                                  20    
HELIX    2   2 ASN A  137  THR A  157  1                                  21    
HELIX    3   3 ASN A  181  LEU A  185  5                                   5    
HELIX    4   4 ASP A  189  ASN A  197  1                                   9    
HELIX    5   5 TYR A  204  ASN A  213  1                                  10    
SHEET    1   A 4 GLN A 161  ILE A 162  0                                        
SHEET    2   A 4 ARG A 125  PHE A 128  1  N  ILE A 126   O  GLN A 161           
SHEET    3   A 4 ILE A 172  THR A 175  1  O  ILE A 174   N  TYR A 127           
SHEET    4   A 4 LYS A 200  SER A 203  1  O  TRP A 202   N  VAL A 173           
SITE     1 AC1  6 THR A 168  LYS A 186  THR A 188  ARG A 193                    
SITE     2 AC1  6 LYS A 196  ASN A 197                                          
SITE     1 AC2  5 ARG A 103  ASN A 137  THR A 138  LYS A 186                    
SITE     2 AC2  5 LYS A 196                                                     
SITE     1 AC3  5 ASN A  99  VAL A 100  LYS A 195  LYS A 200                    
SITE     2 AC3  5 LYS A 206                                                     
CRYST1   83.740   83.740  103.669  90.00  90.00 120.00 P 64 2 2     12          
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      0.011942  0.006895  0.000000        0.00000                         
SCALE2      0.000000  0.013789  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.009646        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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