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Database: PDB
Entry: 5HHE
LinkDB: 5HHE
Original site: 5HHE 
HEADER    CELL CYCLE                              10-JAN-16   5HHE              
TITLE     HUMAN BECLIN 1 COILED-COIL DOMAIN                                     
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: BECLIN-1;                                                  
COMPND   3 CHAIN: D, A;                                                         
COMPND   4 FRAGMENT: UNP ENTRIES 175-265;                                       
COMPND   5 SYNONYM: COILED-COIL MYOSIN-LIKE BCL2-INTERACTING PROTEIN,PROTEIN    
COMPND   6 GT197;                                                               
COMPND   7 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 ORGANISM_TAXID: 9606;                                                
SOURCE   5 GENE: BECN1, GT197;                                                  
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI 'BL21-GOLD(DE3)PLYSS AG';        
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 866768;                                     
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) PLYSS;                           
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET29B                                    
KEYWDS    AUTOPHAGY REGULATOR, COILED-COIL DOMAIN, ANTI-PARALLEL DIMER, CELL    
KEYWDS   2 CYCLE                                                                
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    Y.MEI,S.SINHA                                                         
REVDAT   5   31-AUG-16 5HHE    1       REMARK                                   
REVDAT   4   17-AUG-16 5HHE    1       JRNL                                     
REVDAT   3   03-AUG-16 5HHE    1       JRNL                                     
REVDAT   2   27-JUL-16 5HHE    1       JRNL                                     
REVDAT   1   20-JUL-16 5HHE    0                                                
JRNL        AUTH   Y.MEI,M.SU,R.SANISHVILI,S.CHAKRAVARTHY,C.L.COLBERT,S.C.SINHA 
JRNL        TITL   IDENTIFICATION OF BECN1 AND ATG14 COILED-COIL INTERFACE      
JRNL        TITL 2 RESIDUES THAT ARE IMPORTANT FOR STARVATION-INDUCED           
JRNL        TITL 3 AUTOPHAGY.                                                   
JRNL        REF    BIOCHEMISTRY                  V.  55  4239 2016              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   27383850                                                     
JRNL        DOI    10.1021/ACS.BIOCHEM.6B00246                                  
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.46 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX                                               
REMARK   3   AUTHORS     : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN            
REMARK   3               : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE,           
REMARK   3               : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER,            
REMARK   3               : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY,              
REMARK   3               : REETAL PAI,RANDY READ,JANE RICHARDSON,               
REMARK   3               : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI,           
REMARK   3               : NICHOLAS SAUTER,JACOB SMITH,LAURENT                  
REMARK   3               : STORONI,TOM TERWILLIGER,PETER ZWART                  
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : ML                                            
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 1.46                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 40.15                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.350                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 99.3                           
REMARK   3   NUMBER OF REFLECTIONS             : 38429                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.173                           
REMARK   3   R VALUE            (WORKING SET) : 0.172                           
REMARK   3   FREE R VALUE                     : 0.208                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.000                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 1921                            
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 40.1500 -  3.5093    0.99     2653   140  0.1876 0.2009        
REMARK   3     2  3.5093 -  2.7857    1.00     2634   139  0.1700 0.1700        
REMARK   3     3  2.7857 -  2.4336    1.00     2618   137  0.1707 0.2276        
REMARK   3     4  2.4336 -  2.2111    1.00     2650   140  0.1463 0.1838        
REMARK   3     5  2.2111 -  2.0526    1.00     2628   138  0.1478 0.1998        
REMARK   3     6  2.0526 -  1.9316    1.00     2608   137  0.1562 0.2163        
REMARK   3     7  1.9316 -  1.8349    1.00     2616   138  0.1635 0.2382        
REMARK   3     8  1.8349 -  1.7550    1.00     2629   139  0.1610 0.2595        
REMARK   3     9  1.7550 -  1.6874    1.00     2628   137  0.1512 0.2258        
REMARK   3    10  1.6874 -  1.6292    1.00     2585   137  0.1484 0.2036        
REMARK   3    11  1.6292 -  1.5783    1.00     2621   137  0.1574 0.2157        
REMARK   3    12  1.5783 -  1.5331    1.00     2602   138  0.1869 0.2611        
REMARK   3    13  1.5331 -  1.4928    0.97     2560   133  0.2038 0.3080        
REMARK   3    14  1.4928 -  1.4564    0.94     2476   131  0.2444 0.3170        
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED        : FLAT BULK SOLVENT MODEL                       
REMARK   3   SOLVENT RADIUS     : 1.11                                          
REMARK   3   SHRINKAGE RADIUS   : 0.90                                          
REMARK   3   K_SOL              : NULL                                          
REMARK   3   B_SOL              : NULL                                          
REMARK   3                                                                      
REMARK   3  ERROR ESTIMATES.                                                    
REMARK   3   COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED)     : 0.160            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 24.580           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 32.34                          
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : NULL                                                 
REMARK   3    B22 (A**2) : NULL                                                 
REMARK   3    B33 (A**2) : NULL                                                 
REMARK   3    B12 (A**2) : NULL                                                 
REMARK   3    B13 (A**2) : NULL                                                 
REMARK   3    B23 (A**2) : NULL                                                 
REMARK   3                                                                      
REMARK   3  TWINNING INFORMATION.                                               
REMARK   3   FRACTION: NULL                                                     
REMARK   3   OPERATOR: NULL                                                     
REMARK   3                                                                      
REMARK   3  DEVIATIONS FROM IDEAL VALUES.                                       
REMARK   3                 RMSD          COUNT                                  
REMARK   3   BOND      :  0.007           1589                                  
REMARK   3   ANGLE     :  0.704           2122                                  
REMARK   3   CHIRALITY :  0.043            229                                  
REMARK   3   PLANARITY :  0.002            291                                  
REMARK   3   DIHEDRAL  : 14.350            664                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : NULL                                       
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 5HHE COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 14-JAN-16.                  
REMARK 100 THE DEPOSITION ID IS D_1000217036.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 07-NOV-14                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 7.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : APS                                
REMARK 200  BEAMLINE                       : 23-ID-B                            
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.98                               
REMARK 200  MONOCHROMATOR                  : CRYOGENICALLY-COOLED SINGLE        
REMARK 200                                   CRYSTAL                            
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : MARMOSAIC 325 MM CCD               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 38596                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.460                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 40.150                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.7                               
REMARK 200  DATA REDUNDANCY                : 7.500                              
REMARK 200  R MERGE                    (I) : NULL                               
REMARK 200  R SYM                      (I) : 0.08200                            
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 15.9100                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.46                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.57                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 97.9                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 7.10                               
REMARK 200  R MERGE FOR SHELL          (I) : NULL                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 2.020                              
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: 3Q8T                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 50.61                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.49                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 39% 2-METHYL-2, 4-PENTADIOL, 9% PEG400   
REMARK 280  AND 100 MM TRIS BUFFER, PH 7.5., EVAPORATION, TEMPERATURE 293K      
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1                          
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,Y,-Z                                                 
REMARK 290       3555   X+1/2,Y+1/2,Z                                           
REMARK 290       4555   -X+1/2,Y+1/2,-Z                                         
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   2 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1   3  1.000000  0.000000  0.000000       29.10000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       35.78750            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000       29.10000            
REMARK 290   SMTRY2   4  0.000000  1.000000  0.000000       35.78750            
REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1, 2                                                    
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 4940 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 13730 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -51.0 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: D                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350   BIOMT1   2 -1.000000  0.000000  0.000000      -44.82686            
REMARK 350   BIOMT2   2  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000      107.95505            
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 2                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 4990 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 13780 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -51.0 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 -1.000000  0.000000  0.000000      -44.82686            
REMARK 350   BIOMT2   2  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000      107.95505            
REMARK 470                                                                      
REMARK 470 MISSING ATOM                                                         
REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;           
REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;          
REMARK 470 I=INSERTION CODE):                                                   
REMARK 470   M RES CSSEQI  ATOMS                                                
REMARK 470     GLU A 267    CG   CD   OE1  OE2                                  
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT                     
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.                            
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE          
REMARK 500   OE1  GLN A   240     O    HOH A   301              1.61            
REMARK 500   OE1  GLU D   235     O    HOH D   301              1.91            
REMARK 500   O    HOH D   302     O    HOH D   402              1.94            
REMARK 500   O    HOH D   302     O    HOH D   332              2.03            
REMARK 500   O    HOH D   327     O    HOH D   423              2.05            
REMARK 500   O    HOH D   371     O    HOH D   423              2.07            
REMARK 500   O    HOH A   377     O    HOH A   405              2.08            
REMARK 500   O    HOH D   409     O    HOH D   429              2.11            
REMARK 500   O    HOH A   312     O    HOH A   358              2.13            
REMARK 500   O    HOH D   381     O    HOH D   406              2.14            
REMARK 500   O    HOH D   301     O    HOH D   400              2.17            
REMARK 500   O    HOH A   378     O    HOH A   397              2.17            
REMARK 500   O    HOH A   389     O    HOH A   402              2.18            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS                                             
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC             
REMARK 500 SYMMETRY ARE IN CLOSE CONTACT.  AN ATOM LOCATED WITHIN 0.15          
REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A           
REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375             
REMARK 500 INSTEAD OF REMARK 500.  ATOMS WITH NON-BLANK ALTERNATE               
REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS.            
REMARK 500                                                                      
REMARK 500 DISTANCE CUTOFF:                                                     
REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS              
REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS                  
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI  SSYMOP   DISTANCE          
REMARK 500   O    HOH D   423     O    HOH A   324     2557     2.05            
REMARK 500   O    HOH D   370     O    HOH D   423     2557     2.05            
REMARK 500   O    HOH A   380     O    HOH A   389     2557     2.07            
REMARK 500   O    HOH A   387     O    HOH A   398     1455     2.07            
REMARK 500   O    HOH D   313     O    HOH D   353     2558     2.08            
REMARK 500   O    HOH A   361     O    HOH A   389     2557     2.11            
REMARK 500   O    HOH D   423     O    HOH A   336     2557     2.16            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  5HHE D  175   265  UNP    Q14457   BECN1_HUMAN    175    265             
DBREF  5HHE A  175   265  UNP    Q14457   BECN1_HUMAN    175    265             
SEQADV 5HHE LEU D  266  UNP  Q14457              EXPRESSION TAG                 
SEQADV 5HHE GLU D  267  UNP  Q14457              EXPRESSION TAG                 
SEQADV 5HHE LEU A  266  UNP  Q14457              EXPRESSION TAG                 
SEQADV 5HHE GLU A  267  UNP  Q14457              EXPRESSION TAG                 
SEQRES   1 D   93  ASP ASP SER GLU GLN LEU GLN MET GLU LEU LYS GLU LEU          
SEQRES   2 D   93  ALA LEU GLU GLU GLU ARG LEU ILE GLN GLU LEU GLU ASP          
SEQRES   3 D   93  VAL GLU LYS ASN ARG LYS ILE VAL ALA GLU ASN LEU GLU          
SEQRES   4 D   93  LYS VAL GLN ALA GLU ALA GLU ARG LEU ASP GLN GLU GLU          
SEQRES   5 D   93  ALA GLN TYR GLN ARG GLU TYR SER GLU PHE LYS ARG GLN          
SEQRES   6 D   93  GLN LEU GLU LEU ASP ASP GLU LEU LYS SER VAL GLU ASN          
SEQRES   7 D   93  GLN MET ARG TYR ALA GLN THR GLN LEU ASP LYS LEU LYS          
SEQRES   8 D   93  LEU GLU                                                      
SEQRES   1 A   93  ASP ASP SER GLU GLN LEU GLN MET GLU LEU LYS GLU LEU          
SEQRES   2 A   93  ALA LEU GLU GLU GLU ARG LEU ILE GLN GLU LEU GLU ASP          
SEQRES   3 A   93  VAL GLU LYS ASN ARG LYS ILE VAL ALA GLU ASN LEU GLU          
SEQRES   4 A   93  LYS VAL GLN ALA GLU ALA GLU ARG LEU ASP GLN GLU GLU          
SEQRES   5 A   93  ALA GLN TYR GLN ARG GLU TYR SER GLU PHE LYS ARG GLN          
SEQRES   6 A   93  GLN LEU GLU LEU ASP ASP GLU LEU LYS SER VAL GLU ASN          
SEQRES   7 A   93  GLN MET ARG TYR ALA GLN THR GLN LEU ASP LYS LEU LYS          
SEQRES   8 A   93  LEU GLU                                                      
FORMUL   3  HOH   *255(H2 O)                                                    
HELIX    1 AA1 ASP D  175  GLU D  267  1                                  93    
HELIX    2 AA2 ASP A  176  GLU A  267  1                                  92    
CRYST1   58.200   71.575   58.446  90.00 112.55  90.00 C 1 2 1       8          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      0.017182  0.000000  0.007133        0.00000                         
SCALE2      0.000000  0.013971  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.018526        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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