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LongText Report for: 2QS9-pdb

Name Class
2QS9-pdb
HEADER    STRUCTURAL PROTEIN                      30-JUL-07   2QS9              
TITLE     CRYSTAL STRUCTURE OF THE HUMAN RETINOBLASTOMA-BINDING                 
TITLE    2 PROTEIN 9 (RBBP-9). NESG TARGET HR2978                               
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: RETINOBLASTOMA-BINDING PROTEIN 9;                          
COMPND   3 CHAIN: A, B;                                                         
COMPND   4 SYNONYM: RBBP-9, RETINOBLASTOMA-BINDING PROTEIN 10, RBBP-            
COMPND   5 10, B5T OVEREXPRESSED GENE PROTEIN, BOG PROTEIN;                     
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 GENE: RBBP9, BOG, RBBP10;                                            
SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21-23C                                 
KEYWDS    RETINOBLASTOMA-BINDING PROTEIN 9, RETINOBLASTOMA-BINDING              
KEYWDS   2 PROTEIN 10, B5T OVEREXPRESSED GENE PROTEIN, BOG, RBBP9,              
KEYWDS   3 RBBP10, HR2978, NESG, STRUCTURAL GENOMICS, PSI-2, PROTEIN            
KEYWDS   4 STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS                  
KEYWDS   5 CONSORTIUM, ALTERNATIVE SPLICING, CYTOPLASM, NUCLEUS,                
KEYWDS   6 PHOSPHORYLATION, STRUCTURAL PROTEIN                                  
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    S.M.VOROBIEV,M.SU,J.SEETHARAMAN,A.KUZIN,C.X.CHEN,                     
AUTHOR   2 K.CUNNINGHAM,L.OWENS,M.MAGLAQUI,R.XIAO,T.B.ACTON,                    
AUTHOR   3 G.T.MONTELIONE,J.F.HUNT,L.TONG,NORTHEAST STRUCTURAL                  
AUTHOR   4 GENOMICS CONSORTIUM (NESG)                                           
REVDAT   1   14-AUG-07 2QS9    0                                                
JRNL        AUTH   S.M.VOROBIEV,M.SU,J.SEETHARAMAN,A.KUZIN,C.X.CHEN,            
JRNL        AUTH 2 K.CUNNINGHAM,L.OWENS,R.XIAO,T.B.ACTON,                       
JRNL        AUTH 3 G.T.MONTELIONE,J.F.HUNT,L.TONG                               
JRNL        TITL   CRYSTAL STRUCTURE OF THE HUMAN                               
JRNL        TITL 2 RETINOBLASTOMA-BINDING PROTEIN 9 (RBBP-9).                   
JRNL        REF    TO BE PUBLISHED                                              
JRNL        REFN                                                                
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. 1.72 ANGSTROMS.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CNS 1.1                                              
REMARK   3   AUTHORS     : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE-              
REMARK   3               : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,             
REMARK   3               : READ,RICE,SIMONSON,WARREN                            
REMARK   3                                                                      
REMARK   3  REFINEMENT TARGET : ENGH & HUBER                                    
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 1.72                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 19.96                          
REMARK   3   DATA CUTOFF            (SIGMA(F)) : 2.000                          
REMARK   3   DATA CUTOFF HIGH         (ABS(F)) : 208046.590                     
REMARK   3   DATA CUTOFF LOW          (ABS(F)) : 0.0000                         
REMARK   3   COMPLETENESS (WORKING+TEST)   (%) : 96.5                           
REMARK   3   NUMBER OF REFLECTIONS             : 67213                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : THROUGHOUT                      
REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM                          
REMARK   3   R VALUE            (WORKING SET) : 0.183                           
REMARK   3   FREE R VALUE                     : 0.203                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 4.000                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 2691                            
REMARK   3   ESTIMATED ERROR OF FREE R VALUE  : 0.004                           
REMARK   3                                                                      
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
REMARK   3   TOTAL NUMBER OF BINS USED           : 6                            
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : 1.72                         
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : 1.83                         
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : 89.30                        
REMARK   3   REFLECTIONS IN BIN    (WORKING SET) : 9988                         
REMARK   3   BIN R VALUE           (WORKING SET) : 0.2020                       
REMARK   3   BIN FREE R VALUE                    : 0.2330                       
REMARK   3   BIN FREE R VALUE TEST SET SIZE  (%) : 4.10                         
REMARK   3   BIN FREE R VALUE TEST SET COUNT     : 422                          
REMARK   3   ESTIMATED ERROR OF BIN FREE R VALUE : 0.011                        
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 2963                                    
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 0                                       
REMARK   3   SOLVENT ATOMS            : 414                                     
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 11.90                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 12.90                          
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : -0.40000                                             
REMARK   3    B22 (A**2) : -0.34000                                             
REMARK   3    B33 (A**2) : 0.74000                                              
REMARK   3    B12 (A**2) : 0.00000                                              
REMARK   3    B13 (A**2) : -0.88000                                             
REMARK   3    B23 (A**2) : 0.00000                                              
REMARK   3                                                                      
REMARK   3  ESTIMATED COORDINATE ERROR.                                         
REMARK   3   ESD FROM LUZZATI PLOT        (A) : 0.17                            
REMARK   3   ESD FROM SIGMAA              (A) : 0.05                            
REMARK   3   LOW RESOLUTION CUTOFF        (A) : 5.00                            
REMARK   3                                                                      
REMARK   3  CROSS-VALIDATED ESTIMATED COORDINATE ERROR.                         
REMARK   3   ESD FROM C-V LUZZATI PLOT    (A) : 0.20                            
REMARK   3   ESD FROM C-V SIGMAA          (A) : 0.08                            
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES.                                   
REMARK   3   BOND LENGTHS                 (A) : 0.005                           
REMARK   3   BOND ANGLES            (DEGREES) : 1.30                            
REMARK   3   DIHEDRAL ANGLES        (DEGREES) : 23.60                           
REMARK   3   IMPROPER ANGLES        (DEGREES) : 0.85                            
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL MODEL : RESTRAINED                                
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.    RMS    SIGMA                
REMARK   3   MAIN-CHAIN BOND              (A**2) : NULL  ; NULL                 
REMARK   3   MAIN-CHAIN ANGLE             (A**2) : NULL  ; NULL                 
REMARK   3   SIDE-CHAIN BOND              (A**2) : NULL  ; NULL                 
REMARK   3   SIDE-CHAIN ANGLE             (A**2) : NULL  ; NULL                 
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELING.                                              
REMARK   3   METHOD USED : FLAT MODEL                                           
REMARK   3   KSOL        : 0.36                                                 
REMARK   3   BSOL        : 58.57                                                
REMARK   3                                                                      
REMARK   3  NCS MODEL : NULL                                                    
REMARK   3                                                                      
REMARK   3  NCS RESTRAINTS.                         RMS   SIGMA/WEIGHT          
REMARK   3   GROUP  1  POSITIONAL            (A) : NULL  ; NULL                 
REMARK   3   GROUP  1  B-FACTOR           (A**2) : NULL  ; NULL                 
REMARK   3                                                                      
REMARK   3  PARAMETER FILE  1  : PROTEIN_REP.PARAM                              
REMARK   3  PARAMETER FILE  2  : WATER_REP.PARAM                                
REMARK   3  PARAMETER FILE  3  : ION.PARAM                                      
REMARK   3  PARAMETER FILE  4  : NULL                                           
REMARK   3  TOPOLOGY FILE  1   : PROTEIN.TOP                                    
REMARK   3  TOPOLOGY FILE  2   : WATER.TOP                                      
REMARK   3  TOPOLOGY FILE  3   : ION.TOP                                        
REMARK   3  TOPOLOGY FILE  4   : NULL                                           
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: THE FRIEDEL PAIRS WERE USED FOR           
REMARK   3  PHASING                                                             
REMARK   4                                                                      
REMARK   4 2QS9 COMPLIES WITH FORMAT V. 3.1, 1-AUG-2007                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB.                               
REMARK 100 THE RCSB ID CODE IS RCSB043990.                                      
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 06-JUN-2007                        
REMARK 200  TEMPERATURE           (KELVIN) : 100.0                              
REMARK 200  PH                             : 5.00                               
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : NSLS                               
REMARK 200  BEAMLINE                       : X4A                                
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.97913                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : MIRRORS                            
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : ADSC QUANTUM 4                     
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : HKL-2000                           
REMARK 200  DATA SCALING SOFTWARE          : HKL-2000                           
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 67796                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.720                              
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     (%) : 96.7                               
REMARK 200  DATA REDUNDANCY                : 3.600                              
REMARK 200  R MERGE                    (I) : 0.04600                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200   FOR THE DATA SET  : 25.9000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.72                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.78                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 85.5                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 2.80                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.08200                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200   FOR SHELL         : 14.400                             
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD                          
REMARK 200 SOFTWARE USED: SHELX D/E, SOLVE, RESOLVE                             
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: THE STRUCTURE FACTOR FILE CONTAINS FRIEDEL PAIRS             
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 35.43                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.90                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 40% PEG 4000, 0.1M MAGNESIUM             
REMARK 280  NITRATE, 0.1M SODIUM ACETATE PH 5.0, MICROBATCH UNDER OIL,          
REMARK 280  TEMPERATURE 291K                                                    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1                         
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,1/2+Y,-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       65.17000            
REMARK 290   SMTRY3   2  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 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: MONOMER                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMER                    
REMARK 350 SOFTWARE USED: PISA                                                  
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 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMER                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMER                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 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; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                 
REMARK 465                                                                      
REMARK 465   M RES C  SSEQI                                                     
REMARK 465     MSE A     1                                                      
REMARK 465     ALA A     2                                                      
REMARK 465     MSE B     1                                                      
REMARK 465     ALA B     2                                                      
REMARK 465     LYS B   183                                                      
REMARK 465     VAL B   184                                                      
REMARK 465     PRO B   185                                                      
REMARK 465     ALA B   186                                                      
REMARK 465     LEU B   187                                                      
REMARK 465     GLU B   188                                                      
REMARK 465     HIS B   189                                                      
REMARK 465     HIS B   190                                                      
REMARK 465     HIS B   191                                                      
REMARK 465     HIS B   192                                                      
REMARK 465     HIS B   193                                                      
REMARK 465     HIS B   194                                                      
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     SER A   3    OG                                                  
REMARK 470     LYS A 183    CG    CD    CE    NZ                                
REMARK 470     GLU A 188    CG    CD    OE1   OE2                               
REMARK 470     HIS A 194    CG    ND1   CD2   CE1   NE2                         
REMARK 470     SER B   3    OG                                                  
REMARK 470     ARG B 109    CG    CD    NE    CZ    NH1   NH2                   
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    SER A  75     -111.44     56.08                                   
REMARK 500    SER A  97       61.85     60.85                                   
REMARK 500    PHE A 171       69.32   -158.67                                   
REMARK 500    VAL A 184       73.11     55.28                                   
REMARK 500    SER B  75     -111.98     57.22                                   
REMARK 500    SER B  97       61.46     62.47                                   
REMARK 500    LEU B 103       18.02     58.01                                   
REMARK 500    PHE B 171       69.33   -155.89                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: HR2978   RELATED DB: TARGETDB                            
DBREF  2QS9 A    1   186  UNP    O75884   RBBP9_HUMAN      1    186             
DBREF  2QS9 B    1   186  UNP    O75884   RBBP9_HUMAN      1    186             
SEQADV 2QS9 LEU A  187  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 GLU A  188  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  189  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  190  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  191  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  192  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  193  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS A  194  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 LEU B  187  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 GLU B  188  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  189  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  190  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  191  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  192  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  193  UNP  O75884              EXPRESSION TAG                 
SEQADV 2QS9 HIS B  194  UNP  O75884              EXPRESSION TAG                 
SEQRES   1 A  194  MSE ALA SER PRO SER LYS ALA VAL ILE VAL PRO GLY ASN          
SEQRES   2 A  194  GLY GLY GLY ASP VAL THR THR HIS GLY TRP TYR GLY TRP          
SEQRES   3 A  194  VAL LYS LYS GLU LEU GLU LYS ILE PRO GLY PHE GLN CYS          
SEQRES   4 A  194  LEU ALA LYS ASN MSE PRO ASP PRO ILE THR ALA ARG GLU          
SEQRES   5 A  194  SER ILE TRP LEU PRO PHE MSE GLU THR GLU LEU HIS CYS          
SEQRES   6 A  194  ASP GLU LYS THR ILE ILE ILE GLY HIS SER SER GLY ALA          
SEQRES   7 A  194  ILE ALA ALA MSE ARG TYR ALA GLU THR HIS ARG VAL TYR          
SEQRES   8 A  194  ALA ILE VAL LEU VAL SER ALA TYR THR SER ASP LEU GLY          
SEQRES   9 A  194  ASP GLU ASN GLU ARG ALA SER GLY TYR PHE THR ARG PRO          
SEQRES  10 A  194  TRP GLN TRP GLU LYS ILE LYS ALA ASN CYS PRO TYR ILE          
SEQRES  11 A  194  VAL GLN PHE GLY SER THR ASP ASP PRO PHE LEU PRO TRP          
SEQRES  12 A  194  LYS GLU GLN GLN GLU VAL ALA ASP ARG LEU GLU THR LYS          
SEQRES  13 A  194  LEU HIS LYS PHE THR ASP CYS GLY HIS PHE GLN ASN THR          
SEQRES  14 A  194  GLU PHE HIS GLU LEU ILE THR VAL VAL LYS SER LEU LEU          
SEQRES  15 A  194  LYS VAL PRO ALA LEU GLU HIS HIS HIS HIS HIS HIS              
SEQRES   1 B  194  MSE ALA SER PRO SER LYS ALA VAL ILE VAL PRO GLY ASN          
SEQRES   2 B  194  GLY GLY GLY ASP VAL THR THR HIS GLY TRP TYR GLY TRP          
SEQRES   3 B  194  VAL LYS LYS GLU LEU GLU LYS ILE PRO GLY PHE GLN CYS          
SEQRES   4 B  194  LEU ALA LYS ASN MSE PRO ASP PRO ILE THR ALA ARG GLU          
SEQRES   5 B  194  SER ILE TRP LEU PRO PHE MSE GLU THR GLU LEU HIS CYS          
SEQRES   6 B  194  ASP GLU LYS THR ILE ILE ILE GLY HIS SER SER GLY ALA          
SEQRES   7 B  194  ILE ALA ALA MSE ARG TYR ALA GLU THR HIS ARG VAL TYR          
SEQRES   8 B  194  ALA ILE VAL LEU VAL SER ALA TYR THR SER ASP LEU GLY          
SEQRES   9 B  194  ASP GLU ASN GLU ARG ALA SER GLY TYR PHE THR ARG PRO          
SEQRES  10 B  194  TRP GLN TRP GLU LYS ILE LYS ALA ASN CYS PRO TYR ILE          
SEQRES  11 B  194  VAL GLN PHE GLY SER THR ASP ASP PRO PHE LEU PRO TRP          
SEQRES  12 B  194  LYS GLU GLN GLN GLU VAL ALA ASP ARG LEU GLU THR LYS          
SEQRES  13 B  194  LEU HIS LYS PHE THR ASP CYS GLY HIS PHE GLN ASN THR          
SEQRES  14 B  194  GLU PHE HIS GLU LEU ILE THR VAL VAL LYS SER LEU LEU          
SEQRES  15 B  194  LYS VAL PRO ALA LEU GLU HIS HIS HIS HIS HIS HIS              
MODRES 2QS9 MSE A   44  MET  SELENOMETHIONINE                                   
MODRES 2QS9 MSE A   59  MET  SELENOMETHIONINE                                   
MODRES 2QS9 MSE A   82  MET  SELENOMETHIONINE                                   
MODRES 2QS9 MSE B   44  MET  SELENOMETHIONINE                                   
MODRES 2QS9 MSE B   59  MET  SELENOMETHIONINE                                   
MODRES 2QS9 MSE B   82  MET  SELENOMETHIONINE                                   
HET    MSE  A  44       8                                                       
HET    MSE  A  59       8                                                       
HET    MSE  A  82       8                                                       
HET    MSE  B  44       8                                                       
HET    MSE  B  59       8                                                       
HET    MSE  B  82       8                                                       
HETNAM     MSE SELENOMETHIONINE                                                 
FORMUL   1  MSE    6(C5 H11 N O2 SE)                                            
FORMUL   3  HOH   *414(H2 O)                                                    
HELIX    1   1 TRP A   23  GLU A   32  1                                  10    
HELIX    2   2 ARG A   51  GLU A   62  1                                  12    
HELIX    3   3 SER A   75  HIS A   88  1                                  14    
HELIX    4   4 ASP A  105  SER A  111  1                                   7    
HELIX    5   5 GLN A  119  CYS A  127  1                                   9    
HELIX    6   6 PRO A  142  GLU A  154  1                                  13    
HELIX    7   7 PHE A  171  LYS A  183  1                                  13    
HELIX    8   8 TRP B   23  GLU B   32  1                                  10    
HELIX    9   9 ARG B   51  GLU B   62  1                                  12    
HELIX   10  10 SER B   75  ALA B   85  1                                  11    
HELIX   11  11 ASP B  105  SER B  111  1                                   7    
HELIX   12  12 GLN B  119  CYS B  127  1                                   9    
HELIX   13  13 PRO B  142  GLU B  154  1                                  13    
HELIX   14  14 PHE B  171  LEU B  182  1                                  12    
SHEET    1   A 6 CYS A  39  ALA A  41  0                                        
SHEET    2   A 6 LYS A   6  VAL A  10  1  N  ILE A   9   O  LEU A  40           
SHEET    3   A 6 THR A  69  HIS A  74  1  O  ILE A  72   N  VAL A   8           
SHEET    4   A 6 ALA A  92  VAL A  96  1  O  VAL A  94   N  ILE A  71           
SHEET    5   A 6 TYR A 129  SER A 135  1  O  PHE A 133   N  LEU A  95           
SHEET    6   A 6 LYS A 156  PHE A 160  1  O  HIS A 158   N  GLN A 132           
SHEET    1   B 6 GLN B  38  LEU B  40  0                                        
SHEET    2   B 6 LYS B   6  VAL B  10  1  N  ILE B   9   O  LEU B  40           
SHEET    3   B 6 THR B  69  HIS B  74  1  O  ILE B  72   N  VAL B   8           
SHEET    4   B 6 ALA B  92  VAL B  96  1  O  VAL B  94   N  ILE B  71           
SHEET    5   B 6 TYR B 129  SER B 135  1  O  PHE B 133   N  LEU B  95           
SHEET    6   B 6 LYS B 156  PHE B 160  1  O  HIS B 158   N  GLN B 132           
CRYST1   37.081  130.340   39.047  90.00 115.87  90.00 P 1 21 1      4          
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      0.026968  0.000000  0.013075        0.00000                         
SCALE2      0.000000  0.007672  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.028462        0.00000                         
TER    1532      HIS A 194                                                      
TER    2965      LEU B 182                                                      
MASTER      283    0    6   14   12    0    0    6 3377    2   48   30          
END                                                                             

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Mail to: Nicolas Lenfant, Thierry Hotelier, Yves Bourne, Pascale Marchot and Arnaud Chatonnet.
Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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