GenomeNet

Database: PDB
Entry: 4UQY
LinkDB: 4UQY
Original site: 4UQY 
HEADER    PROTEIN TRANSPORT                       25-JUN-14   4UQY              
TITLE     COEVOLUTION OF THE ATPASE CLPV, THE TSSB-TSSC SHEATH AND              
TITLE    2 THE ACCESSORY HSIE PROTEIN DISTINGUISHES TWO TYPE VI                 
TITLE    3 SECRETION CLASSES                                                    
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: HSIE1;                                                     
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: RESIDUES 21-281;                                           
COMPND   5 ENGINEERED: YES;                                                     
COMPND   6 MOL_ID: 2;                                                           
COMPND   7 MOLECULE: HSIB1;                                                     
COMPND   8 CHAIN: B;                                                            
COMPND   9 FRAGMENT: N TERMINUS, RESIDUES 1-20                                  
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1;                    
SOURCE   3 ORGANISM_TAXID: 208964;                                              
SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI B;                               
SOURCE   5 EXPRESSION_SYSTEM_TAXID: 37762;                                      
SOURCE   6 EXPRESSION_SYSTEM_STRAIN: B834;                                      
SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET-28;                                    
SOURCE   9 MOL_ID: 2;                                                           
SOURCE  10 SYNTHETIC: YES;                                                      
SOURCE  11 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1;                    
SOURCE  12 ORGANISM_TAXID: 208964                                               
KEYWDS    PROTEIN TRANSPORT, SECRETION, SHEATH, DISASSEMBLY, REGULATION,        
KEYWDS   2 BACTERIAL                                                            
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    A.FORSTER,S.PLANAMENTE,E.MANOLI,N.S.LOSSI,P.S.FREEMONT,A.FILLOUX      
REVDAT   2   03-DEC-14 4UQY    1       JRNL                                     
REVDAT   1   22-OCT-14 4UQY    0                                                
JRNL        AUTH   A.FORSTER,S.PLANAMENTE,E.MANOLI,N.S.LOSSI,P.S.FREEMONT,      
JRNL        AUTH 2 A.FILLOUX                                                    
JRNL        TITL   COEVOLUTION OF THE ATPASE CLPV, THE SHEATH PROTEINS TSSB     
JRNL        TITL 2 AND TSSC AND THE ACCESSORY PROTEIN TAGJ/HSIE1 DISTINGUISHES  
JRNL        TITL 3 TYPE VI SECRETION CLASSES.                                   
JRNL        REF    J.BIOL.CHEM.                  V. 289 33032 2014              
JRNL        REFN                   ISSN 0021-9258                               
JRNL        PMID   25305017                                                     
JRNL        DOI    10.1074/JBC.M114.600510                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION.    1.60 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX (PHENIX.REFINE)                               
REMARK   3   AUTHORS     : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN            
REMARK   3               : DAVIS,KRESHNA GOPAL,RALF GROSSE-                     
REMARK   3               : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO,              
REMARK   3               : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL            
REMARK   3               : MORIARTY,REETAL PAI,RANDY READ,JANE                  
REMARK   3               : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM             
REMARK   3               : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH,             
REMARK   3               : LAURENT STORONI,TOM TERWILLIGER,PETER                
REMARK   3               : ZWART                                                
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : ML                                            
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 1.60                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 30.298                         
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 1.35                           
REMARK   3   COMPLETENESS FOR RANGE        (%) : 96.97                          
REMARK   3   NUMBER OF REFLECTIONS             : 35818                          
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.1780                          
REMARK   3   R VALUE            (WORKING SET) : 0.1766                          
REMARK   3   FREE R VALUE                     : 0.2051                          
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.0                             
REMARK   3   FREE R VALUE TEST SET COUNT      : 1806                            
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 30.3034 -  3.7600    0.84     2420   126  0.1652 0.1753        
REMARK   3     2  3.7600 -  2.9853    0.98     2718   134  0.1614 0.1781        
REMARK   3     3  2.9853 -  2.6081    0.99     2692   143  0.1812 0.2128        
REMARK   3     4  2.6081 -  2.3698    0.99     2685   121  0.1751 0.1930        
REMARK   3     5  2.3698 -  2.2000    0.99     2674   157  0.1699 0.2331        
REMARK   3     6  2.2000 -  2.0703    0.99     2654   153  0.1672 0.2101        
REMARK   3     7  2.0703 -  1.9666    0.99     2629   137  0.1713 0.1998        
REMARK   3     8  1.9666 -  1.8810    0.98     2657   130  0.1757 0.2216        
REMARK   3     9  1.8810 -  1.8086    0.97     2571   140  0.1896 0.2499        
REMARK   3    10  1.8086 -  1.7462    0.97     2597   142  0.2031 0.2338        
REMARK   3    11  1.7462 -  1.6916    0.97     2580   145  0.2080 0.2262        
REMARK   3    12  1.6916 -  1.6433    0.97     2599   133  0.2383 0.2743        
REMARK   3    13  1.6433 -  1.6000    0.97     2536   145  0.2818 0.2947        
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)     : 0.15             
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 20.65            
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 18.08                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 29.74                          
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      :  0.006           2182                                  
REMARK   3   ANGLE     :  1.032           2983                                  
REMARK   3   CHIRALITY :  0.041            338                                  
REMARK   3   PLANARITY :  0.005            401                                  
REMARK   3   DIHEDRAL  : 12.396            810                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 5                                          
REMARK   3   TLS GROUP : 1                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 30 THROUGH 88 )                   
REMARK   3    ORIGIN FOR THE GROUP (A):  17.9273 -10.2540   0.6225              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.4785 T22:   0.2912                                     
REMARK   3      T33:   0.1830 T12:   0.0311                                     
REMARK   3      T13:   0.0025 T23:   0.0546                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.6163 L22:   1.8483                                     
REMARK   3      L33:   2.1178 L12:   0.0194                                     
REMARK   3      L13:   0.1910 L23:   0.5496                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0329 S12:  -0.4758 S13:  -0.2591                       
REMARK   3      S21:   0.5885 S22:   0.0633 S23:  -0.1468                       
REMARK   3      S31:   0.5484 S32:   0.0506 S33:  -0.0716                       
REMARK   3   TLS GROUP : 2                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 89 THROUGH 112 )                  
REMARK   3    ORIGIN FOR THE GROUP (A):  19.0343   0.4143 -12.4426              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2526 T22:   0.1814                                     
REMARK   3      T33:   0.1567 T12:   0.0067                                     
REMARK   3      T13:   0.0547 T23:  -0.0082                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.9197 L22:   2.4692                                     
REMARK   3      L33:   8.0179 L12:   0.1832                                     
REMARK   3      L13:   4.2391 L23:   0.8652                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0662 S12:  -0.3133 S13:   0.1234                       
REMARK   3      S21:   0.1184 S22:   0.0996 S23:  -0.0460                       
REMARK   3      S31:  -0.4260 S32:  -0.0277 S33:  -0.0075                       
REMARK   3   TLS GROUP : 3                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 113 THROUGH 156 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  10.2489  -0.4219 -34.9037              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2420 T22:   0.1365                                     
REMARK   3      T33:   0.1659 T12:   0.0268                                     
REMARK   3      T13:  -0.0084 T23:   0.0405                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.3470 L22:   1.0203                                     
REMARK   3      L33:   5.2238 L12:   0.5733                                     
REMARK   3      L13:   0.9351 L23:   0.4939                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0752 S12:   0.1130 S13:   0.2028                       
REMARK   3      S21:  -0.1184 S22:   0.0967 S23:   0.0660                       
REMARK   3      S31:  -0.1847 S32:  -0.4747 S33:  -0.0280                       
REMARK   3   TLS GROUP : 4                                                      
REMARK   3    SELECTION: CHAIN 'A' AND (RESID 157 THROUGH 286 )                 
REMARK   3    ORIGIN FOR THE GROUP (A):  21.9963 -10.4824 -25.3179              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1571 T22:   0.0917                                     
REMARK   3      T33:   0.1638 T12:   0.0225                                     
REMARK   3      T13:   0.0249 T23:  -0.0046                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0318 L22:   1.9631                                     
REMARK   3      L33:   2.5045 L12:   0.4026                                     
REMARK   3      L13:   0.1042 L23:   0.0022                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0082 S12:   0.0098 S13:  -0.0933                       
REMARK   3      S21:   0.0165 S22:   0.0415 S23:  -0.1427                       
REMARK   3      S31:   0.0884 S32:   0.1184 S33:  -0.0239                       
REMARK   3   TLS GROUP : 5                                                      
REMARK   3    SELECTION: CHAIN 'B' AND (RESID 8 THROUGH 20 )                    
REMARK   3    ORIGIN FOR THE GROUP (A):  14.3239 -19.6604 -32.0782              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2729 T22:   0.1575                                     
REMARK   3      T33:   0.1970 T12:  -0.0304                                     
REMARK   3      T13:  -0.0062 T23:  -0.0197                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.5831 L22:   6.4835                                     
REMARK   3      L33:   8.0564 L12:   3.1670                                     
REMARK   3      L13:  -3.5551 L23:  -6.9876                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3333 S12:   0.3228 S13:  -0.0241                       
REMARK   3      S21:  -0.6472 S22:   0.5618 S23:   0.1281                       
REMARK   3      S31:   0.6808 S32:  -0.6138 S33:  -0.1402                       
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 4UQY COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 26-JUN-14.                  
REMARK 100 THE PDBE ID CODE IS EBI-61093.                                       
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 03-FEB-13                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : DIAMOND                            
REMARK 200  BEAMLINE                       : I04                                
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.9800                             
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : ADSC CCD                           
REMARK 200  DETECTOR MANUFACTURER          : ADSC                               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : AIMLESS                            
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 36309                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 1.60                               
REMARK 200  RESOLUTION RANGE LOW       (A) : 53.00                              
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : 1.5                                
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.8                               
REMARK 200  DATA REDUNDANCY                : 3.2                                
REMARK 200  R MERGE                    (I) : 0.06                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 10.70                              
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.60                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 1.63                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 98.5                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 3.2                                
REMARK 200  R MERGE FOR SHELL          (I) : 0.59                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 2.20                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: PDB ENTRY 1ZBP                                       
REMARK 200                                                                      
REMARK 200 REMARK: NONE                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 42.59                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.14                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 50 MM MES (PH 6.5) 100 MM AMMONIUM       
REMARK 280  ACETATE 10% GLYCEROL 28% PEG 8000                                   
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       22.61000            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       47.27000            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       31.98500            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       47.27000            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       22.61000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       31.98500            
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: DIMERIC                           
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 1500 ANGSTROM**2                          
REMARK 350 SURFACE AREA OF THE COMPLEX: 12340 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -4.9 KCAL/MOL                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B                                  
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 465                                                                      
REMARK 465 MISSING RESIDUES                                                     
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                
REMARK 465                                                                      
REMARK 465   M RES C SSSEQI                                                     
REMARK 465     GLY A    26                                                      
REMARK 465     SER A    27                                                      
REMARK 465     HIS A    28                                                      
REMARK 465     MET A    29                                                      
REMARK 465     THR A   287                                                      
REMARK 465     ASP A   288                                                      
REMARK 465     ALA A   289                                                      
REMARK 465     MET B     1                                                      
REMARK 465     GLY B     2                                                      
REMARK 465     SER B     3                                                      
REMARK 465     THR B     4                                                      
REMARK 465     THR B     5                                                      
REMARK 465     SER B     6                                                      
REMARK 465     SER B     7                                                      
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     GLN B   8    CG   CD   OE1  NE2                                  
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    HIS A 142       59.19    -98.68                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 4UQN   RELATED DB: PDB                                   
REMARK 900  TFL1 FORMS A COMPLEX WITH 14-3-3 AND INHIBITS                       
REMARK 900  FLOWERING BY RECRUITING FD AWAY FROM FT CONTAINING                  
REMARK 900  ACTIVATOR COMPLEX                                                   
REMARK 900 RELATED ID: 4UQW   RELATED DB: PDB                                   
REMARK 900  COEVOLUTION OF THE ATPASE CLPV, THE TSSB-TSSC SHEATH                
REMARK 900  AND THE ACCESSORY HSIE PROTEIN DISTINGUISHES TWO TYPE               
REMARK 900  VI SECRETION CLASSES                                                
REMARK 900 RELATED ID: 4UQX   RELATED DB: PDB                                   
REMARK 900  COEVOLUTION OF THE ATPASE CLPV, THE TSSB-TSSC SHEATH                
REMARK 900  AND THE ACCESSORY HSIE PROTEIN DISTINGUISHES TWO TYPE               
REMARK 900  VI SECRETION CLASSES                                                
REMARK 900 RELATED ID: 4UQZ   RELATED DB: PDB                                   
REMARK 900  COEVOLUTION OF THE ATPASE CLPV, THE TSSB-TSSC SHEATH                
REMARK 900  AND THE ACCESSORY HSIE PROTEIN DISTINGUISHES TWO TYPE               
REMARK 900  VI SECRETION CLASSES                                                
DBREF  4UQY A   29   289  UNP    Q9I746   Q9I746_PSEAE    21    281             
DBREF  4UQY B    1    20  UNP    Q9I749   Q9I749_PSEAE     1     20             
SEQADV 4UQY GLY A   26  UNP  Q9I746              EXPRESSION TAG                 
SEQADV 4UQY SER A   27  UNP  Q9I746              EXPRESSION TAG                 
SEQADV 4UQY HIS A   28  UNP  Q9I746              EXPRESSION TAG                 
SEQRES   1 A  264  GLY SER HIS MET ILE ALA GLU GLU LEU LEU ARG ALA GLY          
SEQRES   2 A  264  ARG LEU ASP ASP ALA LEU LYS ALA LEU GLN GLU GLN VAL          
SEQRES   3 A  264  ARG SER GLN PRO SER ASN ALA THR LEU ARG ILE PHE LEU          
SEQRES   4 A  264  PHE GLN LEU LEU ALA VAL MET GLY GLN TRP ALA ARG ALA          
SEQRES   5 A  264  GLN ASN GLN LEU LYS VAL VAL GLY GLU LEU ASP ALA SER          
SEQRES   6 A  264  ALA LEU PRO MET VAL GLN THR TYR SER THR ALA ILE ASP          
SEQRES   7 A  264  CYS GLU ALA LEU ARG ARG GLU VAL PHE ALA GLY ARG LEU          
SEQRES   8 A  264  THR PRO VAL ILE LEU GLY GLN PRO ALA GLU TRP ILE ALA          
SEQRES   9 A  264  PRO LEU LEU GLN ALA LEU SER LEU ASP ALA GLU GLY HIS          
SEQRES  10 A  264  GLY GLU ALA ALA GLN ALA LEU ARG GLU GLN ALA PHE ASP          
SEQRES  11 A  264  ALA ALA PRO ALA VAL PRO GLY ARG ILE GLY GLU ALA PRO          
SEQRES  12 A  264  PHE ALA TRP LEU ALA ASP ALA ASP THR ARG LEU GLY PRO          
SEQRES  13 A  264  VAL LEU GLU VAL ILE VAL ASN GLY ARG TYR ALA TRP LEU          
SEQRES  14 A  264  PRO MET SER ASN LEU ARG SER LEU LYS VAL GLU ALA PRO          
SEQRES  15 A  264  SER ASP LEU ARG ASP LEU VAL TRP LEU PRO ALA GLU LEU          
SEQRES  16 A  264  THR LEU ALA ASN GLY GLY ALA THR VAL ALA LEU LEU PRO          
SEQRES  17 A  264  ALA ARG TYR ALA GLU THR VAL GLU HIS GLY ASP ASP ALA          
SEQRES  18 A  264  ALA ARG LEU GLY ARG LYS THR GLU TRP LEU ASP SER GLY          
SEQRES  19 A  264  LEU PRO VAL GLY GLN ARG LEU PHE VAL THR ASP ALA GLY          
SEQRES  20 A  264  GLU THR ALA LEU PHE ASP LEU ARG GLU LEU ASP PHE GLU          
SEQRES  21 A  264  PRO THR ASP ALA                                              
SEQRES   1 B   20  MET GLY SER THR THR SER SER GLN LYS PHE ILE ALA ARG          
SEQRES   2 B   20  ASN ARG ALA PRO ARG VAL GLN                                  
FORMUL   3  HOH   *197(H2 O)                                                    
HELIX    1   1 ILE A   30  ALA A   37  1                                   8    
HELIX    2   2 ARG A   39  GLN A   54  1                                  16    
HELIX    3   3 ASN A   57  MET A   71  1                                  15    
HELIX    4   4 GLN A   73  ASP A   88  1                                  16    
HELIX    5   5 ALA A   91  ALA A  113  1                                  23    
HELIX    6   6 TRP A  127  GLU A  140  1                                  14    
HELIX    7   7 HIS A  142  ALA A  157  1                                  16    
HELIX    8   8 ASP A  209  LEU A  213  5                                   5    
HELIX    9   9 GLU A  238  GLY A  243  1                                   6    
HELIX   10  10 ASP A  244  LEU A  249  1                                   6    
HELIX   11  11 PHE A  277  LEU A  279  5                                   3    
SHEET    1  AA 3 VAL A 119  ILE A 120  0                                        
SHEET    2  AA 3 ARG A 190  PRO A 195  1  O  TYR A 191   N  VAL A 119           
SHEET    3  AA 3 VAL A 182  VAL A 187 -1  O  LEU A 183   N  LEU A 194           
SHEET    1  AB 6 ALA A 167  PHE A 169  0                                        
SHEET    2  AB 6 GLY A 162  ILE A 164 -1  O  GLY A 162   N  PHE A 169           
SHEET    3  AB 6 GLU A 281  PHE A 284 -1  O  ASP A 283   N  ARG A 163           
SHEET    4  AB 6 LEU A 199  VAL A 204 -1  O  ARG A 200   N  PHE A 284           
SHEET    5  AB 6 TRP A 215  LEU A 222 -1  O  GLU A 219   N  LYS A 203           
SHEET    6  AB 6 ALA A 227  PRO A 233 -1  O  THR A 228   N  LEU A 220           
SHEET    1  AC 3 LEU A 172  ASP A 174  0                                        
SHEET    2  AC 3 LEU A 266  THR A 269 -1  O  VAL A 268   N  ALA A 173           
SHEET    3  AC 3 GLU A 273  ALA A 275 -1  O  THR A 274   N  PHE A 267           
SHEET    1  AD 3 PRO A 261  GLY A 263  0                                        
SHEET    2  AD 3 LYS A 252  TRP A 255 -1  O  GLU A 254   N  VAL A 262           
SHEET    3  AD 3 ARG B  18  VAL B  19 -1  O  ARG B  18   N  THR A 253           
CRYST1   45.220   63.970   94.540  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      0.022114  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.015632  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.010578        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
DBGET integrated database retrieval system