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Database: PDB
Entry: 1RHG
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Original site: 1RHG 
HEADER    GROWTH FACTOR                           29-JAN-93   1RHG              
TITLE     THE STRUCTURE OF GRANULOCYTE-COLONY-STIMULATING FACTOR AND            
TITLE    2 ITS RELATIONSHIP TO THOSE OF OTHER GROWTH FACTORS                    
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: GRANULOCYTE COLONY-STIMULATING FACTOR;                     
COMPND   3 CHAIN: A, B, C;                                                      
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 ORGANISM_TAXID: 9606                                                 
KEYWDS    GROWTH FACTOR                                                         
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    C.P.HILL,T.D.OSSLUND,D.EISENBERG                                      
REVDAT   2   24-FEB-09 1RHG    1       VERSN                                    
REVDAT   1   31-JAN-94 1RHG    0                                                
JRNL        AUTH   C.P.HILL,T.D.OSSLUND,D.EISENBERG                             
JRNL        TITL   THE STRUCTURE OF GRANULOCYTE-COLONY-STIMULATING              
JRNL        TITL 2 FACTOR AND ITS RELATIONSHIP TO OTHER GROWTH                  
JRNL        TITL 3 FACTORS.                                                     
JRNL        REF    PROC.NATL.ACAD.SCI.USA        V.  90  5167 1993              
JRNL        REFN                   ISSN 0027-8424                               
JRNL        PMID   7685117                                                      
JRNL        DOI    10.1073/PNAS.90.11.5167                                      
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   T.D.OSSLUND,R.LUTHY,D.CASCIO,D.EISENBERG                     
REMARK   1  TITL   TOWARDS AUTOMATED CRYSTALLIZATION                            
REMARK   1  REF    TO BE PUBLISHED                                              
REMARK   1  REFN                                                                
REMARK   1 REFERENCE 2                                                          
REMARK   1  AUTH   H.S.LU,C.L.CLOGSTON,L.O.NARHI,L.A.MEREWETHER,                
REMARK   1  AUTH 2 W.R.PEARL,T.C.BOONE                                          
REMARK   1  TITL   FOLDING AND OXIDATION OF RECOMBINANT HUMAN                   
REMARK   1  TITL 2 GRANULOCYTE COLONY STIMULATING FACTOR PRODUCED IN            
REMARK   1  TITL 3 ESCHERICHIA COLI. CHARACTERIZATION OF THE                    
REMARK   1  TITL 4 DISULFIDE-REDUCED INTERMEDIATES AND                          
REMARK   1  TITL 5 CYSTEINE-SERINE ANALOGS                                      
REMARK   1  REF    J.BIOL.CHEM.                  V. 267  8770 1992              
REMARK   1  REFN                   ISSN 0021-9258                               
REMARK   1 REFERENCE 3                                                          
REMARK   1  AUTH   L.M.SOUZA,T.C.BOONE,J.GABRILOVE,P.H.LAI,K.M.ZSEBO,           
REMARK   1  AUTH 2 D.C.MURDOCK,V.R.CHAZIN,J.BRUSZEWSKI,H.LU,K.C.CHEN,           
REMARK   1  AUTH 3 J.BARENDT,E.PLATZER,M.A.S.MOORE,R.MERTELSMANN,               
REMARK   1  AUTH 4 K.WELTE                                                      
REMARK   1  TITL   RECOMBINANT HUMAN GRANULOCYTE COLONY-STIMULATING             
REMARK   1  TITL 2 FACTOR: EFFECTS ON NORMAL AND LEUKEMIC MYELOID               
REMARK   1  TITL 3 CELLS                                                        
REMARK   1  REF    SCIENCE                       V. 232    61 1986              
REMARK   1  REFN                   ISSN 0036-8075                               
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.20 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR                                               
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : NULL                           
REMARK   3   DATA CUTOFF            (SIGMA(F)) : NULL                           
REMARK   3   DATA CUTOFF HIGH         (ABS(F)) : NULL                           
REMARK   3   DATA CUTOFF LOW          (ABS(F)) : NULL                           
REMARK   3   COMPLETENESS (WORKING+TEST)   (%) : NULL                           
REMARK   3   NUMBER OF REFLECTIONS             : NULL                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : NULL                            
REMARK   3   FREE R VALUE TEST SET SELECTION  : NULL                            
REMARK   3   R VALUE            (WORKING SET) : 0.215                           
REMARK   3   FREE R VALUE                     : NULL                            
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : NULL                            
REMARK   3   FREE R VALUE TEST SET COUNT      : NULL                            
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           : NULL                         
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : NULL                         
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : NULL                         
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : NULL                         
REMARK   3   REFLECTIONS IN BIN    (WORKING SET) : NULL                         
REMARK   3   BIN R VALUE           (WORKING SET) : NULL                         
REMARK   3   BIN FREE R VALUE                    : NULL                         
REMARK   3   BIN FREE R VALUE TEST SET SIZE  (%) : NULL                         
REMARK   3   BIN FREE R VALUE TEST SET COUNT     : NULL                         
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            : 3994                                    
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 0                                       
REMARK   3   SOLVENT ATOMS            : 120                                     
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
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  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) : 0.017                           
REMARK   3   BOND ANGLES            (DEGREES) : 3.35                            
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) : 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  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  : NULL                                           
REMARK   3  TOPOLOGY FILE  1   : NULL                                           
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1RHG COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.                                
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : NULL                               
REMARK 200  TEMPERATURE           (KELVIN) : NULL                               
REMARK 200  PH                             : NULL                               
REMARK 200  NUMBER OF CRYSTALS USED        : NULL                               
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : NULL                               
REMARK 200  RADIATION SOURCE               : NULL                               
REMARK 200  BEAMLINE                       : NULL                               
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : NULL                               
REMARK 200  WAVELENGTH OR RANGE        (A) : NULL                               
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : NULL                               
REMARK 200  DETECTOR MANUFACTURER          : NULL                               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : NULL                               
REMARK 200  DATA SCALING SOFTWARE          : NULL                               
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : NULL                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : NULL                               
REMARK 200  RESOLUTION RANGE LOW       (A) : NULL                               
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : NULL                               
REMARK 200  DATA REDUNDANCY                : NULL                               
REMARK 200  R MERGE                    (I) : NULL                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : NULL                               
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : NULL                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : NULL                               
REMARK 200  DATA REDUNDANCY IN SHELL       : NULL                               
REMARK 200  R MERGE FOR SHELL          (I) : NULL                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: NULL                                           
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL                         
REMARK 200 SOFTWARE USED: X-PLOR                                                
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 44.59                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.22                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: NULL                                     
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       45.45000            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       24.75000            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       55.35000            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       24.75000            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       45.45000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       55.35000            
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: TRIMERIC                          
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C                               
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     THR A     1                                                      
REMARK 465     PRO A     2                                                      
REMARK 465     LEU A     3                                                      
REMARK 465     GLY A     4                                                      
REMARK 465     PRO A     5                                                      
REMARK 465     ALA A     6                                                      
REMARK 465     SER A     7                                                      
REMARK 465     SER A     8                                                      
REMARK 465     SER A    62                                                      
REMARK 465     SER A    63                                                      
REMARK 465     CYS A    64                                                      
REMARK 465     PRO A    65                                                      
REMARK 465     SER A    66                                                      
REMARK 465     GLN A    67                                                      
REMARK 465     ALA A    68                                                      
REMARK 465     LEU A    69                                                      
REMARK 465     GLN A    70                                                      
REMARK 465     ALA A   127                                                      
REMARK 465     PRO A   128                                                      
REMARK 465     ALA A   129                                                      
REMARK 465     LEU A   130                                                      
REMARK 465     GLN A   131                                                      
REMARK 465     PRO A   132                                                      
REMARK 465     THR A   133                                                      
REMARK 465     GLN A   134                                                      
REMARK 465     GLY A   135                                                      
REMARK 465     ALA A   136                                                      
REMARK 465     GLN A   173                                                      
REMARK 465     PRO A   174                                                      
REMARK 465     THR B     1                                                      
REMARK 465     PRO B     2                                                      
REMARK 465     LEU B     3                                                      
REMARK 465     GLY B     4                                                      
REMARK 465     PRO B     5                                                      
REMARK 465     ALA B     6                                                      
REMARK 465     SER B     7                                                      
REMARK 465     SER B     8                                                      
REMARK 465     PRO B    65                                                      
REMARK 465     SER B    66                                                      
REMARK 465     GLN B    67                                                      
REMARK 465     ALA B    68                                                      
REMARK 465     LEU B    69                                                      
REMARK 465     GLN B    70                                                      
REMARK 465     GLU B   123                                                      
REMARK 465     LEU B   124                                                      
REMARK 465     GLY B   125                                                      
REMARK 465     MET B   126                                                      
REMARK 465     ALA B   127                                                      
REMARK 465     PRO B   128                                                      
REMARK 465     ALA B   129                                                      
REMARK 465     LEU B   130                                                      
REMARK 465     GLN B   131                                                      
REMARK 465     PRO B   132                                                      
REMARK 465     THR B   133                                                      
REMARK 465     GLN B   134                                                      
REMARK 465     GLY B   135                                                      
REMARK 465     ALA B   136                                                      
REMARK 465     GLN B   173                                                      
REMARK 465     PRO B   174                                                      
REMARK 465     THR C     1                                                      
REMARK 465     PRO C     2                                                      
REMARK 465     LEU C     3                                                      
REMARK 465     GLY C     4                                                      
REMARK 465     PRO C     5                                                      
REMARK 465     ALA C     6                                                      
REMARK 465     SER C     7                                                      
REMARK 465     SER C     8                                                      
REMARK 465     SER C    62                                                      
REMARK 465     SER C    63                                                      
REMARK 465     CYS C    64                                                      
REMARK 465     PRO C    65                                                      
REMARK 465     SER C    66                                                      
REMARK 465     GLN C    67                                                      
REMARK 465     ALA C    68                                                      
REMARK 465     LEU C    69                                                      
REMARK 465     GLN C    70                                                      
REMARK 465     ALA C   127                                                      
REMARK 465     PRO C   128                                                      
REMARK 465     ALA C   129                                                      
REMARK 465     LEU C   130                                                      
REMARK 465     GLN C   131                                                      
REMARK 465     PRO C   132                                                      
REMARK 465     THR C   133                                                      
REMARK 465     GLN C   134                                                      
REMARK 465     GLY C   135                                                      
REMARK 465     ALA C   136                                                      
REMARK 465     GLN C   173                                                      
REMARK 465     PRO C   174                                                      
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     ARG A 147    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     ARG A 166    CG   CD   NE   CZ   NH1  NH2                        
REMARK 470     LEU B  71    CG   CD1  CD2                                       
REMARK 470     SER B  76    OG                                                  
REMARK 470     GLN B  86    CG   CD   OE1  NE2                                  
REMARK 470     LYS C  16    CG   CD   CE   NZ                                   
REMARK 470     GLU C 123    CG   CD   OE1  OE2                                  
REMARK 470     LEU C 124    CG   CD1  CD2                                       
REMARK 470     ARG C 166    CG   CD   NE   CZ   NH1  NH2                        
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS                                      
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)               
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   RES CSSEQI ATM2   DEVIATION                     
REMARK 500    HIS A  52   NE2   HIS A  52   CD2    -0.066                       
REMARK 500    HIS B  52   NE2   HIS B  52   CD2    -0.070                       
REMARK 500    HIS B  79   NE2   HIS B  79   CD2    -0.073                       
REMARK 500    GLU B  98   CD    GLU B  98   OE1     0.088                       
REMARK 500    HIS B 156   NE2   HIS B 156   CD2    -0.078                       
REMARK 500    CYS C  36   CA    CYS C  36   CB     -0.085                       
REMARK 500    HIS C  43   NE2   HIS C  43   CD2    -0.072                       
REMARK 500    VAL C 153   CA    VAL C 153   CB      0.136                       
REMARK 500    HIS C 156   NE2   HIS C 156   CD2    -0.072                       
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500    GLU A  19   CA  -  CB  -  CG  ANGL. DEV. =  14.2 DEGREES          
REMARK 500    ARG A  22   NE  -  CZ  -  NH1 ANGL. DEV. =  -3.4 DEGREES          
REMARK 500    TYR A  39   CB  -  CG  -  CD2 ANGL. DEV. =  -5.2 DEGREES          
REMARK 500    TRP A  58   CD1 -  CG  -  CD2 ANGL. DEV. =   5.9 DEGREES          
REMARK 500    TRP A  58   CE2 -  CD2 -  CG  ANGL. DEV. =  -6.0 DEGREES          
REMARK 500    TRP A 118   CD1 -  CG  -  CD2 ANGL. DEV. =   6.1 DEGREES          
REMARK 500    TRP A 118   CB  -  CG  -  CD1 ANGL. DEV. =  -8.1 DEGREES          
REMARK 500    TRP A 118   CE2 -  CD2 -  CG  ANGL. DEV. =  -5.8 DEGREES          
REMARK 500    TRP A 118   CG  -  CD2 -  CE3 ANGL. DEV. =   5.7 DEGREES          
REMARK 500    MET A 137   CG  -  SD  -  CE  ANGL. DEV. =  10.8 DEGREES          
REMARK 500    PHE A 140   N   -  CA  -  C   ANGL. DEV. = -16.3 DEGREES          
REMARK 500    ARG A 146   NE  -  CZ  -  NH1 ANGL. DEV. =   5.1 DEGREES          
REMARK 500    ARG A 146   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.7 DEGREES          
REMARK 500    CYS B  17   CA  -  CB  -  SG  ANGL. DEV. = -13.3 DEGREES          
REMARK 500    ARG B  22   NE  -  CZ  -  NH2 ANGL. DEV. =   4.5 DEGREES          
REMARK 500    ALA B  37   CB  -  CA  -  C   ANGL. DEV. =  -9.3 DEGREES          
REMARK 500    TRP B  58   CD1 -  CG  -  CD2 ANGL. DEV. =   8.4 DEGREES          
REMARK 500    TRP B  58   CG  -  CD1 -  NE1 ANGL. DEV. =  -6.4 DEGREES          
REMARK 500    TRP B  58   CE2 -  CD2 -  CG  ANGL. DEV. =  -6.7 DEGREES          
REMARK 500    TYR B  85   CB  -  CG  -  CD1 ANGL. DEV. =  -3.7 DEGREES          
REMARK 500    TRP B 118   CD1 -  CG  -  CD2 ANGL. DEV. =   5.4 DEGREES          
REMARK 500    TRP B 118   CE2 -  CD2 -  CG  ANGL. DEV. =  -5.6 DEGREES          
REMARK 500    GLN B 145   CA  -  CB  -  CG  ANGL. DEV. = -14.4 DEGREES          
REMARK 500    ARG C  22   NE  -  CZ  -  NH1 ANGL. DEV. =   5.6 DEGREES          
REMARK 500    ARG C  22   NE  -  CZ  -  NH2 ANGL. DEV. =  -4.1 DEGREES          
REMARK 500    TRP C  58   CD1 -  CG  -  CD2 ANGL. DEV. =   5.3 DEGREES          
REMARK 500    TRP C  58   CE2 -  CD2 -  CG  ANGL. DEV. =  -5.6 DEGREES          
REMARK 500    TRP C  58   CG  -  CD2 -  CE3 ANGL. DEV. =   5.9 DEGREES          
REMARK 500    TRP C 118   CD1 -  CG  -  CD2 ANGL. DEV. =   7.0 DEGREES          
REMARK 500    TRP C 118   CG  -  CD1 -  NE1 ANGL. DEV. =  -6.2 DEGREES          
REMARK 500    TRP C 118   CE2 -  CD2 -  CG  ANGL. DEV. =  -5.7 DEGREES          
REMARK 500    GLN C 145   CA  -  CB  -  CG  ANGL. DEV. = -13.7 DEGREES          
REMARK 500    ARG C 146   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.8 DEGREES          
REMARK 500    ARG C 147   NE  -  CZ  -  NH1 ANGL. DEV. =   5.6 DEGREES          
REMARK 500    ARG C 147   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.5 DEGREES          
REMARK 500    SER C 155   N   -  CA  -  CB  ANGL. DEV. =  -9.1 DEGREES          
REMARK 500    TYR C 165   CB  -  CG  -  CD2 ANGL. DEV. =  -4.5 DEGREES          
REMARK 500    ARG C 169   NE  -  CZ  -  NH1 ANGL. DEV. =   3.1 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    GLN A  11      -30.20    -38.07                                   
REMARK 500    LYS A  40       25.22     47.64                                   
REMARK 500    ILE A  95      -66.61     61.47                                   
REMARK 500    LEU B  61      -44.22   -152.38                                   
REMARK 500    SER B  63       12.16    -69.01                                   
REMARK 500    ALA B  72      -49.02    -16.14                                   
REMARK 500    GLU B  93       41.89     39.88                                   
REMARK 500    ILE B  95      -70.18     54.31                                   
REMARK 500    PRO B 138      169.02    -46.12                                   
REMARK 500    ALA B 141       24.76    -50.86                                   
REMARK 500    ALA C  37      -71.41    -68.36                                   
REMARK 500    ALA C  72      -85.18     47.83                                   
REMARK 500    GLU C  93       58.27     31.77                                   
REMARK 500    ILE C  95      -62.04     62.25                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  1RHG A    1   174  UNP    P09919   CSF3_HUMAN      31    207             
DBREF  1RHG B    1   174  UNP    P09919   CSF3_HUMAN      31    207             
DBREF  1RHG C    1   174  UNP    P09919   CSF3_HUMAN      31    207             
SEQADV 1RHG     A       UNP  P09919    VAL    66 DELETION                       
SEQADV 1RHG     A       UNP  P09919    SER    67 DELETION                       
SEQADV 1RHG     A       UNP  P09919    GLU    68 DELETION                       
SEQADV 1RHG     B       UNP  P09919    VAL    66 DELETION                       
SEQADV 1RHG     B       UNP  P09919    SER    67 DELETION                       
SEQADV 1RHG     B       UNP  P09919    GLU    68 DELETION                       
SEQADV 1RHG     C       UNP  P09919    VAL    66 DELETION                       
SEQADV 1RHG     C       UNP  P09919    SER    67 DELETION                       
SEQADV 1RHG     C       UNP  P09919    GLU    68 DELETION                       
SEQRES   1 A  174  THR PRO LEU GLY PRO ALA SER SER LEU PRO GLN SER PHE          
SEQRES   2 A  174  LEU LEU LYS CYS LEU GLU GLN VAL ARG LYS ILE GLN GLY          
SEQRES   3 A  174  ASP GLY ALA ALA LEU GLN GLU LYS LEU CYS ALA THR TYR          
SEQRES   4 A  174  LYS LEU CYS HIS PRO GLU GLU LEU VAL LEU LEU GLY HIS          
SEQRES   5 A  174  SER LEU GLY ILE PRO TRP ALA PRO LEU SER SER CYS PRO          
SEQRES   6 A  174  SER GLN ALA LEU GLN LEU ALA GLY CYS LEU SER GLN LEU          
SEQRES   7 A  174  HIS SER GLY LEU PHE LEU TYR GLN GLY LEU LEU GLN ALA          
SEQRES   8 A  174  LEU GLU GLY ILE SER PRO GLU LEU GLY PRO THR LEU ASP          
SEQRES   9 A  174  THR LEU GLN LEU ASP VAL ALA ASP PHE ALA THR THR ILE          
SEQRES  10 A  174  TRP GLN GLN MET GLU GLU LEU GLY MET ALA PRO ALA LEU          
SEQRES  11 A  174  GLN PRO THR GLN GLY ALA MET PRO ALA PHE ALA SER ALA          
SEQRES  12 A  174  PHE GLN ARG ARG ALA GLY GLY VAL LEU VAL ALA SER HIS          
SEQRES  13 A  174  LEU GLN SER PHE LEU GLU VAL SER TYR ARG VAL LEU ARG          
SEQRES  14 A  174  HIS LEU ALA GLN PRO                                          
SEQRES   1 B  174  THR PRO LEU GLY PRO ALA SER SER LEU PRO GLN SER PHE          
SEQRES   2 B  174  LEU LEU LYS CYS LEU GLU GLN VAL ARG LYS ILE GLN GLY          
SEQRES   3 B  174  ASP GLY ALA ALA LEU GLN GLU LYS LEU CYS ALA THR TYR          
SEQRES   4 B  174  LYS LEU CYS HIS PRO GLU GLU LEU VAL LEU LEU GLY HIS          
SEQRES   5 B  174  SER LEU GLY ILE PRO TRP ALA PRO LEU SER SER CYS PRO          
SEQRES   6 B  174  SER GLN ALA LEU GLN LEU ALA GLY CYS LEU SER GLN LEU          
SEQRES   7 B  174  HIS SER GLY LEU PHE LEU TYR GLN GLY LEU LEU GLN ALA          
SEQRES   8 B  174  LEU GLU GLY ILE SER PRO GLU LEU GLY PRO THR LEU ASP          
SEQRES   9 B  174  THR LEU GLN LEU ASP VAL ALA ASP PHE ALA THR THR ILE          
SEQRES  10 B  174  TRP GLN GLN MET GLU GLU LEU GLY MET ALA PRO ALA LEU          
SEQRES  11 B  174  GLN PRO THR GLN GLY ALA MET PRO ALA PHE ALA SER ALA          
SEQRES  12 B  174  PHE GLN ARG ARG ALA GLY GLY VAL LEU VAL ALA SER HIS          
SEQRES  13 B  174  LEU GLN SER PHE LEU GLU VAL SER TYR ARG VAL LEU ARG          
SEQRES  14 B  174  HIS LEU ALA GLN PRO                                          
SEQRES   1 C  174  THR PRO LEU GLY PRO ALA SER SER LEU PRO GLN SER PHE          
SEQRES   2 C  174  LEU LEU LYS CYS LEU GLU GLN VAL ARG LYS ILE GLN GLY          
SEQRES   3 C  174  ASP GLY ALA ALA LEU GLN GLU LYS LEU CYS ALA THR TYR          
SEQRES   4 C  174  LYS LEU CYS HIS PRO GLU GLU LEU VAL LEU LEU GLY HIS          
SEQRES   5 C  174  SER LEU GLY ILE PRO TRP ALA PRO LEU SER SER CYS PRO          
SEQRES   6 C  174  SER GLN ALA LEU GLN LEU ALA GLY CYS LEU SER GLN LEU          
SEQRES   7 C  174  HIS SER GLY LEU PHE LEU TYR GLN GLY LEU LEU GLN ALA          
SEQRES   8 C  174  LEU GLU GLY ILE SER PRO GLU LEU GLY PRO THR LEU ASP          
SEQRES   9 C  174  THR LEU GLN LEU ASP VAL ALA ASP PHE ALA THR THR ILE          
SEQRES  10 C  174  TRP GLN GLN MET GLU GLU LEU GLY MET ALA PRO ALA LEU          
SEQRES  11 C  174  GLN PRO THR GLN GLY ALA MET PRO ALA PHE ALA SER ALA          
SEQRES  12 C  174  PHE GLN ARG ARG ALA GLY GLY VAL LEU VAL ALA SER HIS          
SEQRES  13 C  174  LEU GLN SER PHE LEU GLU VAL SER TYR ARG VAL LEU ARG          
SEQRES  14 C  174  HIS LEU ALA GLN PRO                                          
FORMUL   4  HOH   *40(H2 O)                                                     
HELIX    1  AA GLN A   11  TYR A   39  1                                  29    
HELIX    2 A3A PRO A   44  VAL A   48  5                                   5    
HELIX    3  BA LEU A   71  ALA A   91  1                                  21    
HELIX    4 ALA GLU A   93  ILE A   95  6                                   3    
HELIX    5  CA GLY A  100  GLU A  123  1                                  24    
HELIX    6  DA ALA A  143  ALA A  172  1                                  30    
HELIX    7  AB GLN B   11  TYR B   39  1                                  29    
HELIX    8 A3B PRO B   44  VAL B   48  5                                   5    
HELIX    9  BB LEU B   71  ALA B   91  1                                  21    
HELIX   10 ALB GLU B   93  ILE B   95  6                                   3    
HELIX   11  DB ALA B  143  ALA B  172  1                                  30    
HELIX   12  AC GLN C   11  TYR C   39  1                                  29    
HELIX   13 A3C PRO C   44  VAL C   48  5                                   5    
HELIX   14  BC LEU C   71  ALA C   91  1                                  21    
HELIX   15 ALC GLU C   93  ILE C   95  6                                   3    
HELIX   16  CC GLY C  100  GLU C  123  1                                  24    
HELIX   17  DC ALA C  143  ALA C  172  1                                  30    
SSBOND   1 CYS A   36    CYS A   42                          1555   1555  2.01  
SSBOND   2 CYS B   36    CYS B   42                          1555   1555  2.03  
SSBOND   3 CYS B   64    CYS B   74                          1555   1555  2.04  
SSBOND   4 CYS C   36    CYS C   42                          1555   1555  2.02  
CRYST1   90.900  110.700   49.500  90.00  90.00  90.00 P 21 21 21   12          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      0.011001  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.009033  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.020202        0.00000                         
MTRIX1   1  0.837465  0.162405  0.521802        0.38900    1                    
MTRIX2   1 -0.294485 -0.670224  0.681233       83.49600    1                    
MTRIX3   1  0.460360 -0.724171 -0.513463        8.97800    1                    
MTRIX1   2 -0.763481  0.140255  0.630416       69.62000    1                    
MTRIX2   2  0.120204 -0.928217  0.352085      101.21500    1                    
MTRIX3   2  0.634545  0.344589  0.691817      -46.85700    1                    
MTRIX1   3 -0.382797  0.549495  0.742645       27.05900    1                    
MTRIX2   3 -0.664126  0.395119 -0.634679       39.81400    1                    
MTRIX3   3 -0.642186 -0.736163  0.213684       76.86200    1                    
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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