REMARK 2 REMARK 2 RESOLUTION. 2.86 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.8.1_1168) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VICENT 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) : 2.86 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 24.95 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.950 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.0 REMARK 3 NUMBER OF REFLECTIONS : 65721 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.212 REMARK 3 R VALUE (WORKING SET) : 0.210 REMARK 3 FREE R VALUE : 0.256 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.060 REMARK 3 FREE R VALUE TEST SET COUNT : 3326 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 24.9513 - 8.1485 0.99 2690 160 0.2247 0.2466 REMARK 3 2 8.1485 - 6.5054 1.00 2693 115 0.1936 0.2001 REMARK 3 3 6.5054 - 5.6942 1.00 2642 149 0.1978 0.2477 REMARK 3 4 5.6942 - 5.1787 1.00 2663 125 0.1840 0.2623 REMARK 3 5 5.1787 - 4.8103 1.00 2647 135 0.1771 0.2258 REMARK 3 6 4.8103 - 4.5285 1.00 2632 128 0.1766 0.2113 REMARK 3 7 4.5285 - 4.3029 1.00 2624 154 0.1785 0.2346 REMARK 3 8 4.3029 - 4.1165 1.00 2628 133 0.1872 0.2097 REMARK 3 9 4.1165 - 3.9586 1.00 2613 139 0.2048 0.2438 REMARK 3 10 3.9586 - 3.8225 1.00 2647 138 0.2061 0.2510 REMARK 3 11 3.8225 - 3.7034 1.00 2590 144 0.2121 0.2663 REMARK 3 12 3.7034 - 3.5979 1.00 2640 140 0.2209 0.2824 REMARK 3 13 3.5979 - 3.5034 1.00 2597 144 0.2223 0.2553 REMARK 3 14 3.5034 - 3.4182 1.00 2574 166 0.2326 0.3174 REMARK 3 15 3.4182 - 3.3406 1.00 2653 136 0.2430 0.2928 REMARK 3 16 3.3406 - 3.2697 1.00 2613 140 0.2371 0.3150 REMARK 3 17 3.2697 - 3.2044 1.00 2593 146 0.2452 0.3288 REMARK 3 18 3.2044 - 3.1441 1.00 2635 120 0.2489 0.3254 REMARK 3 19 3.1441 - 3.0880 1.00 2584 157 0.2598 0.3452 REMARK 3 20 3.0880 - 3.0358 1.00 2645 127 0.2666 0.3093 REMARK 3 21 3.0358 - 2.9869 1.00 2574 141 0.2669 0.3419 REMARK 3 22 2.9869 - 2.9410 0.99 2630 146 0.2777 0.2998 REMARK 3 23 2.9410 - 2.8978 0.94 2421 128 0.2806 0.3500 REMARK 3 24 2.8978 - 2.8571 0.82 2167 115 0.3071 0.3374 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) : 0.380 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 29.960 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 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 : 0.009 13553 REMARK 3 ANGLE : 1.227 18438 REMARK 3 CHIRALITY : 0.076 2121 REMARK 3 PLANARITY : 0.006 2314 REMARK 3 DIHEDRAL : 15.194 4770 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 : 6 REMARK 3 NCS GROUP : 1 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'A' and (resseq 25:455 ) REMARK 3 SELECTION : chain 'B' and (resseq 25:455 ) REMARK 3 ATOM PAIRS NUMBER : 3214 REMARK 3 RMSD : 0.249 REMARK 3 NCS GROUP : 2 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'D' and (resseq 1:7 or resseq 13:25 REMARK 3 or resseq 29:36 or resseq 46:51 or resseq REMARK 3 60:65 or resseq 69:77 or resseq 85:101 or REMARK 3 resseq 105:143 or resseq 157:166 or resseq REMARK 3 169:186 ) REMARK 3 SELECTION : chain 'F' and (resseq 1:7 or resseq 13:25 REMARK 3 or resseq 29:36 or resseq 46:51 or resseq REMARK 3 60:65 or resseq 69:77 or resseq 85:101 or REMARK 3 resseq 105:143 or resseq 157:166 or resseq REMARK 3 169:186 ) REMARK 3 ATOM PAIRS NUMBER : 1031 REMARK 3 RMSD : 1.417 REMARK 3 NCS GROUP : 3 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'D' and (resseq 37:39 or resseq 81: REMARK 3 84 or resseq 102:104 or resseq 146:156 or REMARK 3 resseq 187:192 or resseq 198:211 ) REMARK 3 SELECTION : chain 'F' and (resseq 37:39 or resseq 81: REMARK 3 84 or resseq 102:104 or resseq 146:156 or REMARK 3 resseq 187:192 or resseq 198:211 ) REMARK 3 ATOM PAIRS NUMBER : 332 REMARK 3 RMSD : 0.730 REMARK 3 NCS GROUP : 4 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'D' and (resseq 8:12 or resseq 26: REMARK 3 28 or resseq 40:45 or resseq 52:59 or REMARK 3 resseq 66:68 ) REMARK 3 SELECTION : chain 'F' and (resseq 8:12 or resseq 26: REMARK 3 28 or resseq 40:45 or resseq 52:59 or REMARK 3 resseq 66:68 ) REMARK 3 ATOM PAIRS NUMBER : 168 REMARK 3 RMSD : 0.265 REMARK 3 NCS GROUP : 5 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'C' and (resseq 2:123 or resseq REMARK 3 154:156 or resseq 174:178 or resseq 181: REMARK 3 183 ) REMARK 3 SELECTION : chain 'E' and (resseq 2:123 or resseq REMARK 3 154:156 or resseq 174:178 or resseq 181: REMARK 3 183 ) REMARK 3 ATOM PAIRS NUMBER : 1054 REMARK 3 RMSD : 0.688 REMARK 3 NCS GROUP : 6 REMARK 3 NCS OPERATOR : 1 REMARK 3 REFERENCE SELECTION: chain 'C' and (resseq 124:153 or resseq REMARK 3 157:173 or resseq 184:222 ) REMARK 3 SELECTION : chain 'E' and (resseq 124:153 or resseq REMARK 3 157:173 or resseq 184:222 ) REMARK 3 ATOM PAIRS NUMBER : 604 REMARK 3 RMSD : 0.312 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 4KK8 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 06-MAY-13. REMARK 100 THE RCSB ID CODE IS RCSB079442. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 77 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.2.2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL, SI(111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315R REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 65721 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.860 REMARK 200 RESOLUTION RANGE LOW (A) : 25.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 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 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 67.92 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.83 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 24% PEG400, 100MM NA/K TARTRATE, 100MM REMARK 280 GLYCINE, PH 8.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 295K 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 115.61300 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 49.45150 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 115.61300 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 49.45150 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, 3 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: 7050 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 30750 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -47.0 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 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: 3670 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 19640 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -23.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, 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 REMARK 350 BIOMOLECULE: 3 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: 3610 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 19330 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -23.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, F REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 16 REMARK 465 GLU A 459 REMARK 465 GLN A 460 REMARK 465 LYS A 461 REMARK 465 MET B 16 REMARK 465 GLN B 460 REMARK 465 LYS B 461 REMARK 465 GLU C 1 REMARK 465 GLU E 1 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 LEU B 78 CA - CB - CG ANGL. DEV. = 14.3 DEGREES REMARK 500 PRO D 8 C - N - CA ANGL. DEV. = -9.0 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 ASP A 73 -62.94 -106.59 REMARK 500 ALA A 101 85.03 -156.54 REMARK 500 LEU A 212 67.74 -108.37 REMARK 500 ASN A 233 17.64 -145.74 REMARK 500 GLU A 235 -8.29 74.68 REMARK 500 ALA A 309 65.72 -162.79 REMARK 500 PHE A 357 -70.67 -52.48 REMARK 500 ASN A 418 65.44 -115.56 REMARK 500 THR A 439 33.98 -94.65 REMARK 500 ALA B 101 81.12 -154.92 REMARK 500 SER B 107 -70.81 -56.38 REMARK 500 GLU B 203 -66.28 -144.14 REMARK 500 LEU B 212 66.07 -111.10 REMARK 500 HIS B 234 171.36 -57.71 REMARK 500 GLU B 235 -10.90 69.39 REMARK 500 PHE B 307 -52.11 -121.20 REMARK 500 ALA B 309 69.80 -162.49 REMARK 500 PHE B 357 -70.76 -44.05 REMARK 500 ASN B 418 60.86 -114.46 REMARK 500 PRO B 443 109.36 -52.01 REMARK 500 GLU B 457 28.78 -77.15 REMARK 500 ARG C 31 -7.44 64.32 REMARK 500 LYS C 43 -156.64 -117.21 REMARK 500 SER C 55 17.74 55.54 REMARK 500 PRO C 62 100.27 -51.52 REMARK 500 SER C 63 -140.34 -143.01 REMARK 500 LYS C 85 44.37 39.58 REMARK 500 ALA C 137 49.39 -90.09 REMARK 500 ALA C 140 95.55 -61.67 REMARK 500 ALA C 141 -156.70 -85.88 REMARK 500 TYR D 31 71.56 56.81 REMARK 500 THR D 50 -51.77 61.87 REMARK 500 THR D 76 90.18 64.39 REMARK 500 ALA D 83 -174.32 -179.77 REMARK 500 TRP D 90 17.03 -155.04 REMARK 500 LYS D 102 110.79 51.24 REMARK 500 THR D 125 9.22 -57.12 REMARK 500 ASN D 137 72.53 48.44 REMARK 500 PRO D 140 -174.53 -68.46 REMARK 500 ASP D 169 9.56 -163.01 REMARK 500 ASP E 28 97.74 -67.39 REMARK 500 ARG E 31 -9.91 63.79 REMARK 500 LYS E 43 -168.39 -101.03 REMARK 500 PRO E 62 77.51 -44.72 REMARK 500 SER E 63 -146.18 -116.19 REMARK 500 TYR E 100 -169.54 -167.73 REMARK 500 ALA E 122 -173.93 -65.56 REMARK 500 SER E 136 79.64 -55.47 REMARK 500 ALA E 137 34.87 141.97 REMARK 500 ALA E 139 97.61 -57.02 REMARK 500 REMARK 500 THIS ENTRY HAS 58 RAMACHANDRAN OUTLIERS. REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE F A 501 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE F B 501 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4KK5 RELATED DB: PDB REMARK 900 RELATED ID: 4KK6 RELATED DB: PDB REMARK 900 RELATED ID: 4KJW RELATED DB: PDB REMARK 900 RELATED ID: 4KK9 RELATED DB: PDB REMARK 900 RELATED ID: 4KKA RELATED DB: PDB REMARK 900 RELATED ID: 4KKB RELATED DB: PDB REMARK 900 RELATED ID: 4KKC RELATED DB: PDB REMARK 900 RELATED ID: 4KJP RELATED DB: PDB REMARK 900 RELATED ID: 4KJQ RELATED DB: PDB