GenomeNet

Database: PDB
Entry: 1FMG
LinkDB: 1FMG
Original site: 1FMG 
ANISOU   52  NH2 ARG A   7     8667   9718   8939   -422   -713   -767       N  
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
HEADER    HYDROLASE                               22-SEP-11   3TWL              
TITLE     CRYSTAL STRUCTURE OF ARABIDOPSIS THALIANA FPG                         
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE 1;                     
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: UNP RESIDUES 1-302;                                        
COMPND   5 EC: 3.2.2.23;                                                        
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA;                           
SOURCE   3 ORGANISM_COMMON: MOUSE-EAR CRESS, THALE-CRESS;                       
SOURCE   4 ORGANISM_TAXID: 3702;                                                
SOURCE   5 GENE: FPG1;                                                          
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: ROSETTA (DE3) PLYSS;                       
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET22B                                    
KEYWDS    HELIX TWO TURNS HELIX, ZINC-LESS FINGER, HYDROLASE, DNA DAMAGE, DNA   
KEYWDS   2 REPAIR, DNA-BINDING, GLYCOSIDASE, LYASE, MULTIFUNCTIONAL ENZYME      
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    S.DUCLOS,P.ALLER,S.S.WALLACE,S.DOUBLIE                                
REVDAT   2   29-AUG-12 3TWL    1       JRNL                                     
REVDAT   1   25-JUL-12 3TWL    0                                                
JRNL        AUTH   S.DUCLOS,P.ALLER,P.JARUGA,M.DIZDAROGLU,S.S.WALLACE,S.DOUBLIE 
JRNL        TITL   STRUCTURAL AND BIOCHEMICAL STUDIES OF A PLANT                
JRNL        TITL 2 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE REVEAL WHY EUKARYOTIC    
JRNL        TITL 3 FPG GLYCOSYLASES DO NOT EXCISE 8-OXOGUANINE.                 
JRNL        REF    DNA REPAIR                    V.  11   714 2012              
JRNL        REFN                   ISSN 1568-7864                               
JRNL        PMID   22789755                                                     
JRNL        DOI    10.1016/J.DNAREP.2012.06.004                                 
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.70 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CNS                                                  
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) : 1.70                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 20.00                          
REMARK   3   DATA CUTOFF            (SIGMA(F)) : 0.000                          
REMARK   3   DATA CUTOFF HIGH         (ABS(F)) : NULL                           
REMARK   3   DATA CUTOFF LOW          (ABS(F)) : NULL                           
REMARK   3   COMPLETENESS (WORKING+TEST)   (%) : 89.5                           
REMARK   3   NUMBER OF REFLECTIONS             : 58601                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : NULL                            
REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM                          
REMARK   3   R VALUE            (WORKING SET) : 0.210                           
REMARK   3   FREE R VALUE                     : 0.219                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 8.800                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 5777                            
REMARK   3   ESTIMATED ERROR OF FREE R VALUE  : NULL                            
REMARK   3                                                                      
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
REMARK   3   TOTAL NUMBER OF BINS USED           : 50                           
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : 1.70                         
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : 1.71                         
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : NULL                         
REMARK   3   REFLECTIONS IN BIN    (WORKING SET) : 648                          
REMARK   3   BIN R VALUE           (WORKING SET) : 0.4218                       
REMARK   3   BIN FREE R VALUE                    : 0.4080                       
REMARK   3   BIN FREE R VALUE TEST SET SIZE  (%) : NULL                         
REMARK   3   BIN FREE R VALUE TEST SET COUNT     : 56                           
REMARK   3   ESTIMATED ERROR OF BIN FREE R VALUE : NULL                         
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 2076                                    
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 6                                       
REMARK   3   SOLVENT ATOMS            : 207                                     
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 27.91                          
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : 1.22600                                              
REMARK   3    B22 (A**2) : 5.60600                                              
REMARK   3    B33 (A**2) : -6.83200                                             
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  ESTIMATED COORDINATE ERROR.                                         
REMARK   3   ESD FROM LUZZATI PLOT        (A) : NULL                            
REMARK   3   ESD FROM SIGMAA              (A) : NULL                            
REMARK   3   LOW RESOLUTION CUTOFF        (A) : NULL                            
REMARK   3                                                                      
REMARK   3  CROSS-VALIDATED ESTIMATED COORDINATE ERROR.                         
REMARK   3   ESD FROM C-V LUZZATI PLOT    (A) : NULL                            
REMARK   3   ESD FROM C-V SIGMAA          (A) : NULL                            
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES.                                   
REMARK   3   BOND LENGTHS                 (A) : 0.005                           
REMARK   3   BOND ANGLES            (DEGREES) : NULL                            
REMARK   3   DIHEDRAL ANGLES        (DEGREES) : NULL                            
REMARK   3   IMPROPER ANGLES        (DEGREES) : NULL                            
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL MODEL : NULL                                      
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.    RMS    SIGMA                
REMARK   3   MAIN-CHAIN BOND              (A**2) : 1.230 ; 1.500                
REMARK   3   MAIN-CHAIN ANGLE             (A**2) : 1.849 ; 2.000                
REMARK   3   SIDE-CHAIN BOND              (A**2) : 2.029 ; 2.000                
REMARK   3   SIDE-CHAIN ANGLE             (A**2) : 3.022 ; 2.500                
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELING.                                              
REMARK   3   METHOD USED : NULL                                                 
REMARK   3   KSOL        : NULL                                                 
REMARK   3   BSOL        : 57.08                                                
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  : CNS_TOPPAR:PROTEIN_REP.PARAM                   
REMARK   3  PARAMETER FILE  2  : CNS_TOPPAR:DNA-RNA_REP.PARAM                   
REMARK   3  PARAMETER FILE  3  : CNS_TOPPAR:WATER_REP.PARAM                     
REMARK   3  PARAMETER FILE  4  : CNS_TOPPAR:ION.PARAM                           
REMARK   3  PARAMETER FILE  5  : HETERO_CPDS.PAR                                
REMARK   3  PARAMETER FILE  6  : NULL                                           
REMARK   3  TOPOLOGY FILE  1   : CNS_TOPPAR:PROTEIN.TOP                         
REMARK   3  TOPOLOGY FILE  2   : CNS_TOPPAR:DNA-RNA.TOP                         
REMARK   3  TOPOLOGY FILE  3   : CNS_TOPPAR:WATER.TOP                           
REMARK   3  TOPOLOGY FILE  4   : CNS_TOPPAR:ION.TOP                             
REMARK   3  TOPOLOGY FILE  5   : HETERO_CPDS.TOP                                
REMARK   3  TOPOLOGY FILE  6   : NULL                                           
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 3TWL COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 05-OCT-11.                  
REMARK 100 THE RCSB ID CODE IS RCSB068010.                                      
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 09-DEC-08                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : N                                  
REMARK 200  RADIATION SOURCE               : ROTATING ANODE                     
REMARK 200  BEAMLINE                       : NULL                               
REMARK 200  X-RAY GENERATOR MODEL          : RIGAKU RU200                       
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 1.5418                             
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : MIRRORS                            
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : MAR SCANNER 345 MM PLATE           
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : DENZO                              
REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 58601                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.700                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 20.000                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 94.7                               
REMARK 200  DATA REDUNDANCY                : 8.500                              
REMARK 200  R MERGE                    (I) : 0.07900                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 18.3000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.70                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.76                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 82.7                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 4.90                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.44500                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
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: 3TWK                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 44.31                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.21                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 32% 15/4EO/OH, 150 MM (NH4)2SO4, 50 MM   
REMARK 280  BIS-TRIS PH 6.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 285K    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21                       
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X+1/2,-Y,Z+1/2                                         
REMARK 290       3555   -X,Y+1/2,-Z+1/2                                         
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       25.34400            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       48.50800            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       31.22400            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       48.50800            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       25.34400            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       31.22400            
REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC                  
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 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     MET A     1                                                      
REMARK 465     GLY A    86                                                      
REMARK 465     VAL A    87                                                      
REMARK 465     ALA A    88                                                      
REMARK 465     VAL A    89                                                      
REMARK 465     THR A    90                                                      
REMARK 465     LYS A    91                                                      
REMARK 465     TYR A    92                                                      
REMARK 465     LYS A    93                                                      
REMARK 465     ARG A    94                                                      
REMARK 465     SER A    95                                                      
REMARK 465     ALA A    96                                                      
REMARK 465     VAL A    97                                                      
REMARK 465     LYS A    98                                                      
REMARK 465     ASP A    99                                                      
REMARK 465     SER A   100                                                      
REMARK 465     GLU A   101                                                      
REMARK 465     GLU A   102                                                      
REMARK 465     THR A   263                                                      
REMARK 465     ALA A   264                                                      
REMARK 465     GLY A   265                                                      
REMARK 465     GLY A   266                                                      
REMARK 465     ARG A   267                                                      
REMARK 465     THR A   268                                                      
REMARK 465     LYS A   288                                                      
REMARK 465     VAL A   289                                                      
REMARK 465     ARG A   290                                                      
REMARK 465     PRO A   291                                                      
REMARK 465     ALA A   292                                                      
REMARK 465     LYS A   293                                                      
REMARK 465     ARG A   294                                                      
REMARK 465     GLY A   295                                                      
REMARK 465     VAL A   296                                                      
REMARK 465     LYS A   297                                                      
REMARK 465     PRO A   298                                                      
REMARK 465     LYS A   299                                                      
REMARK 465     GLU A   300                                                      
REMARK 465     ASP A   301                                                      
REMARK 465     ASP A   302                                                      
REMARK 465     GLY A   303                                                      
REMARK 465     ASP A   304                                                      
REMARK 465     HIS A   305                                                      
REMARK 465     HIS A   306                                                      
REMARK 465     HIS A   307                                                      
REMARK 465     HIS A   308                                                      
REMARK 465     HIS A   309                                                      
REMARK 465     HIS A   310                                                      
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    PRO A 104      109.69    -40.94                                   
REMARK 500    LYS A 168       48.76    -86.81                                   
REMARK 500    TYR A 180      -61.24    -91.21                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 401                 
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 3TWK   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 3TWM   RELATED DB: PDB                                   
DBREF  3TWL A    1   304  UNP    Q9SBB4   Q9SBB4_ARATH     1    304             
SEQADV 3TWL HIS A  305  UNP  Q9SBB4              EXPRESSION TAG                 
SEQADV 3TWL HIS A  306  UNP  Q9SBB4              EXPRESSION TAG                 
SEQADV 3TWL HIS A  307  UNP  Q9SBB4              EXPRESSION TAG                 
SEQADV 3TWL HIS A  308  UNP  Q9SBB4              EXPRESSION TAG                 
SEQADV 3TWL HIS A  309  UNP  Q9SBB4              EXPRESSION TAG                 
SEQADV 3TWL HIS A  310  UNP  Q9SBB4              EXPRESSION TAG                 
SEQRES   1 A  310  MET PRO GLU LEU PRO GLU VAL GLU ALA ALA ARG ARG ALA          
SEQRES   2 A  310  ILE GLU GLU ASN CYS LEU GLY LYS LYS ILE LYS ARG VAL          
SEQRES   3 A  310  ILE ILE ALA ASP ASP ASN LYS VAL ILE HIS GLY ILE SER          
SEQRES   4 A  310  PRO SER ASP PHE GLN THR SER ILE LEU GLY LYS THR ILE          
SEQRES   5 A  310  ILE SER ALA ARG ARG LYS GLY LYS ASN LEU TRP LEU GLU          
SEQRES   6 A  310  LEU ASP SER PRO PRO PHE PRO SER PHE GLN PHE GLY MET          
SEQRES   7 A  310  ALA GLY ALA ILE TYR ILE LYS GLY VAL ALA VAL THR LYS          
SEQRES   8 A  310  TYR LYS ARG SER ALA VAL LYS ASP SER GLU GLU TRP PRO          
SEQRES   9 A  310  SER LYS TYR SER LYS PHE PHE VAL GLU LEU ASP ASP GLY          
SEQRES  10 A  310  LEU GLU LEU SER PHE THR ASP LYS ARG ARG PHE ALA LYS          
SEQRES  11 A  310  VAL ARG LEU LEU ALA ASN PRO THR SER VAL SER PRO ILE          
SEQRES  12 A  310  SER GLU LEU GLY PRO ASP ALA LEU LEU GLU PRO MET THR          
SEQRES  13 A  310  VAL ASP GLU PHE ALA GLU SER LEU ALA LYS LYS LYS ILE          
SEQRES  14 A  310  THR ILE LYS PRO LEU LEU LEU ASP GLN GLY TYR ILE SER          
SEQRES  15 A  310  GLY ILE GLY ASN TRP ILE ALA ASP GLU VAL LEU TYR GLN          
SEQRES  16 A  310  ALA ARG ILE HIS PRO LEU GLN THR ALA SER SER LEU SER          
SEQRES  17 A  310  LYS GLU GLN CYS GLU ALA LEU HIS THR SER ILE LYS GLU          
SEQRES  18 A  310  VAL ILE GLU LYS ALA VAL GLU VAL ASP ALA ASP SER SER          
SEQRES  19 A  310  GLN PHE PRO SER ASN TRP ILE PHE HIS ASN ARG GLU LYS          
SEQRES  20 A  310  LYS PRO GLY LYS ALA PHE VAL ASP GLY LYS LYS ILE ASP          
SEQRES  21 A  310  PHE ILE THR ALA GLY GLY ARG THR THR ALA TYR VAL PRO          
SEQRES  22 A  310  GLU LEU GLN LYS LEU TYR GLY LYS ASP ALA GLU LYS ALA          
SEQRES  23 A  310  ALA LYS VAL ARG PRO ALA LYS ARG GLY VAL LYS PRO LYS          
SEQRES  24 A  310  GLU ASP ASP GLY ASP HIS HIS HIS HIS HIS HIS                  
HET    GOL  A 401       6                                                       
HETNAM     GOL GLYCEROL                                                         
HETSYN     GOL GLYCERIN; PROPANE-1,2,3-TRIOL                                    
FORMUL   2  GOL    C3 H8 O3                                                     
FORMUL   3  HOH   *207(H2 O)                                                    
HELIX    1   1 GLU A    3  CYS A   18  1                                  16    
HELIX    2   2 SER A   39  LEU A   48  1                                  10    
HELIX    3   3 ASN A  136  VAL A  140  5                                   5    
HELIX    4   4 PRO A  142  LEU A  146  5                                   5    
HELIX    5   5 THR A  156  LYS A  166  1                                  11    
HELIX    6   6 THR A  170  ASP A  177  1                                   8    
HELIX    7   7 GLY A  185  ALA A  196  1                                  12    
HELIX    8   8 THR A  203  LEU A  207  5                                   5    
HELIX    9   9 SER A  208  VAL A  229  1                                  22    
HELIX   10  10 ASP A  232  PHE A  236  5                                   5    
HELIX   11  11 TRP A  240  ARG A  245  5                                   6    
HELIX   12  12 TYR A  279  ALA A  287  1                                   9    
SHEET    1   A 4 ILE A  23  ILE A  28  0                                        
SHEET    2   A 4 SER A 108  LEU A 114 -1  O  PHE A 111   N  ILE A  27           
SHEET    3   A 4 GLU A 119  THR A 123 -1  O  PHE A 122   N  LYS A 109           
SHEET    4   A 4 ALA A  81  LYS A  85 -1  N  TYR A  83   O  SER A 121           
SHEET    1   B 4 ILE A  52  LYS A  58  0                                        
SHEET    2   B 4 ASN A  61  LEU A  66 -1  O  GLU A  65   N  ILE A  53           
SHEET    3   B 4 PHE A  71  GLN A  75 -1  O  PHE A  74   N  LEU A  62           
SHEET    4   B 4 LYS A 130  LEU A 134 -1  O  LEU A 134   N  PHE A  71           
SHEET    1   C 2 PHE A 253  VAL A 254  0                                        
SHEET    2   C 2 LYS A 257  LYS A 258 -1  O  LYS A 257   N  VAL A 254           
CISPEP   1 PRO A   69    PRO A   70          0         0.26                     
CISPEP   2 TRP A  103    PRO A  104          0         0.40                     
CISPEP   3 SER A  141    PRO A  142          0        -0.10                     
SITE     1 AC1  6 PRO A   2  GLU A   3  LYS A  60  GLY A 185                    
SITE     2 AC1  6 ASN A 186  HOH A 580                                          
CRYST1   50.688   62.448   97.016  90.00  90.00  90.00 P 21 21 21    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      0.019729  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.016013  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.010308        0.00000                         
(ATOM LINES ARE NOT SHOWN.)

DBGET integrated database retrieval system