Header list of 1cok.pdb file
Complete list - b 16 2 Bytes
HEADER GENE REGULATION 28-MAY-99 1COK
TITLE STRUCTURE OF THE C-TERMINAL DOMAIN OF P73
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: PROTEIN (SECOND SPLICE VARIANT P73);
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: C-TERMINAL DOMAIN;
COMPND 5 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 3 ORGANISM_COMMON: HUMAN;
SOURCE 4 ORGANISM_TAXID: 9606;
SOURCE 5 VARIANT: P73ALPHA;
SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);
SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008;
SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET15B
KEYWDS P73 SAM-LIKE DOMAIN, GENE REGULATION
EXPDTA SOLUTION NMR
NUMMDL 18
AUTHOR S.-W.CHI,A.AYED,C.H.ARROWSMITH
REVDAT 4 16-FEB-22 1COK 1 REMARK
REVDAT 3 24-FEB-09 1COK 1 VERSN
REVDAT 2 01-APR-03 1COK 1 JRNL
REVDAT 1 17-AUG-99 1COK 0
JRNL AUTH S.W.CHI,A.AYED,C.H.ARROWSMITH
JRNL TITL SOLUTION STRUCTURE OF A CONSERVED C-TERMINAL DOMAIN OF P73
JRNL TITL 2 WITH STRUCTURAL HOMOLOGY TO THE SAM DOMAIN.
JRNL REF EMBO J. V. 18 4438 1999
JRNL REFN ISSN 0261-4189
JRNL PMID 10449409
JRNL DOI 10.1093/EMBOJ/18.16.4438
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : X-PLOR, ARIA
REMARK 3 AUTHORS : BRUNGER (X-PLOR), NILGES (ARIA)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: REFINEMENT DETAILS CAN BE FOUND IN J.
REMARK 3 MOL BIOL. 1997 JUN 13;269(3) : 408-22.
REMARK 4
REMARK 4 1COK COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-JUN-99.
REMARK 100 THE DEPOSITION ID IS D_1000001127.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298.0
REMARK 210 PH : 6.0
REMARK 210 IONIC STRENGTH : 150MM NACL, 25MM SODIUM
REMARK 210 PHOSPHATE
REMARK 210 PRESSURE : NULL
REMARK 210 SAMPLE CONTENTS : 10% WATER/90% D2O
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : C13; N15 EDITED NOESY
REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 600 MHZ
REMARK 210 SPECTROMETER MODEL : UNITY 600; UNITYPLUS 500
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : X-PLOR, ARIA
REMARK 210 METHOD USED : SIMULATED ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 30
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 18
REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST RESTRAINT VIOLATION
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 7
REMARK 210
REMARK 210 REMARK:
REMARK 210 THE STRUCTURE WAS DETERMINED USING TRIPLE- RESONANCE NMR
REMARK 210 SPECTROSCOPY ON C13,
REMARK 210 N15-LABELED P73 C- TERMINAL DOMAIN.
REMARK 215
REMARK 215 NMR STUDY
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION
REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON
REMARK 215 THESE RECORDS ARE MEANINGLESS.
REMARK 300
REMARK 300 BIOMOLECULE: 1
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
REMARK 300 BURIED SURFACE AREA.
REMARK 350
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
REMARK 350
REMARK 350 BIOMOLECULE: 1
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: CLOSE CONTACTS
REMARK 500
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
REMARK 500
REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
REMARK 500 O ILE A 20 H THR A 24 1.55
REMARK 500 O SER A 30 H HIS A 33 1.56
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 1 HIS A 2 94.87 50.41
REMARK 500 1 ALA A 3 148.36 67.32
REMARK 500 1 SER A 6 73.72 -64.91
REMARK 500 1 LEU A 7 -50.41 177.30
REMARK 500 1 CYS A 16 67.21 -116.12
REMARK 500 1 LEU A 28 39.75 -99.24
REMARK 500 1 LYS A 46 21.37 82.44
REMARK 500 1 PRO A 48 136.76 -39.66
REMARK 500 1 TYR A 51 30.28 -140.36
REMARK 500 1 GLN A 64 -80.23 -60.98
REMARK 500 2 ALA A 3 171.79 -55.36
REMARK 500 2 LEU A 7 -50.75 -179.17
REMARK 500 2 ASN A 18 25.13 -143.00
REMARK 500 2 LEU A 28 40.78 -99.20
REMARK 500 2 LYS A 46 19.43 86.63
REMARK 500 2 PRO A 48 151.26 -36.81
REMARK 500 2 TYR A 51 33.72 -140.66
REMARK 500 2 ASP A 67 128.85 -178.85
REMARK 500 3 ASP A 4 64.43 -159.31
REMARK 500 3 LEU A 28 40.01 -99.50
REMARK 500 3 PRO A 48 112.81 -37.66
REMARK 500 3 GLU A 49 63.18 -68.15
REMARK 500 3 TYR A 51 28.64 -140.06
REMARK 500 3 ASP A 67 132.64 176.30
REMARK 500 4 LEU A 7 -61.77 -147.91
REMARK 500 4 LEU A 28 39.89 -99.40
REMARK 500 4 PRO A 48 176.30 -49.70
REMARK 500 4 GLU A 49 40.65 -91.59
REMARK 500 4 TYR A 51 25.64 -140.24
REMARK 500 4 GLN A 64 -78.40 -57.03
REMARK 500 5 ALA A 3 156.03 70.54
REMARK 500 5 ASP A 4 76.66 64.63
REMARK 500 5 LEU A 7 -59.19 -167.04
REMARK 500 5 ASN A 18 20.34 -143.47
REMARK 500 5 LEU A 28 39.28 -99.69
REMARK 500 5 LYS A 46 19.46 86.17
REMARK 500 5 GLU A 49 47.21 -89.01
REMARK 500 5 LYS A 63 37.50 -95.53
REMARK 500 5 ASP A 67 24.15 -152.29
REMARK 500 6 LEU A 28 44.62 -99.19
REMARK 500 6 LYS A 46 21.98 83.34
REMARK 500 6 PRO A 48 153.12 -38.07
REMARK 500 6 TYR A 51 31.96 -140.69
REMARK 500 6 LYS A 63 32.66 -92.92
REMARK 500 6 GLN A 64 -81.61 -53.55
REMARK 500 6 ASP A 67 141.83 179.78
REMARK 500 7 HIS A 2 167.93 63.57
REMARK 500 7 ASP A 4 -64.08 -173.89
REMARK 500 7 LEU A 7 -51.94 -168.00
REMARK 500 7 LEU A 28 38.59 -99.40
REMARK 500
REMARK 500 THIS ENTRY HAS 133 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
DBREF 1COK A 1 68 UNP O15350 P73_HUMAN 439 506
SEQRES 1 A 68 TYR HIS ALA ASP PRO SER LEU VAL SER PHE LEU THR GLY
SEQRES 2 A 68 LEU GLY CYS PRO ASN CYS ILE GLU TYR PHE THR SER GLN
SEQRES 3 A 68 GLY LEU GLN SER ILE TYR HIS LEU GLN ASN LEU THR ILE
SEQRES 4 A 68 GLU ASP LEU GLY ALA LEU LYS ILE PRO GLU GLN TYR ARG
SEQRES 5 A 68 MET THR ILE TRP ARG GLY LEU GLN ASP LEU LYS GLN GLY
SEQRES 6 A 68 HIS ASP TYR
HELIX 1 H1 PRO A 5 GLY A 13 1 9
HELIX 2 H2 ILE A 20 THR A 24 1 5
HELIX 3 H4 ILE A 39 LEU A 45 1 7
HELIX 4 H5 ARG A 52 GLN A 64 1 13
CISPEP 1 ASP A 4 PRO A 5 9 5.69
CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
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 1.000000 0.000000 0.000000 0.00000
SCALE2 0.000000 1.000000 0.000000 0.00000
SCALE3 0.000000 0.000000 1.000000 0.00000
MODEL 1
Complete list - b 16 2 Bytes