Header list of 1ewi.pdb file
Complete list - 16 20 Bytes
HEADER REPLICATION 25-APR-00 1EWI
TITLE HUMAN REPLICATION PROTEIN A: GLOBAL FOLD OF THE N-TERMINAL RPA-70
TITLE 2 DOMAIN REVEALS A BASIC CLEFT AND FLEXIBLE C-TERMINAL LINKER
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: REPLICATION PROTEIN A;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: N-TERMINAL FRAGMENT (RESIDUES 1-114);
COMPND 5 SYNONYM: RPA70
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 3 ORGANISM_COMMON: HUMAN;
SOURCE 4 ORGANISM_TAXID: 9606
KEYWDS 5-STRANDED ANTI-PARALLEL, BETA BARREL, REPLICATION
EXPDTA SOLUTION NMR
AUTHOR D.M.JACOBS,A.S.LIPTON,N.G.ISERN,G.W.DAUGHDRILL,D.F.LOWRY,X.GOMES,
AUTHOR 2 M.S.WOLD
REVDAT 3 16-FEB-22 1EWI 1 REMARK
REVDAT 2 24-FEB-09 1EWI 1 VERSN
REVDAT 1 10-MAY-00 1EWI 0
JRNL AUTH D.M.JACOBS,A.S.LIPTON,N.G.ISERN,G.W.DAUGHDRILL,D.F.LOWRY,
JRNL AUTH 2 X.GOMES,M.S.WOLD
JRNL TITL HUMAN REPLICATION PROTEIN A: GLOBAL FOLD OF THE N-TERMINAL
JRNL TITL 2 RPA-70 DOMAIN REVEALS A BASIC CLEFT AND FLEXIBLE C-TERMINAL
JRNL TITL 3 LINKER.
JRNL REF J.BIOMOL.NMR V. 14 321 1999
JRNL REFN ISSN 0925-2738
JRNL PMID 10526407
JRNL DOI 10.1023/A:1008373009786
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : FELIX 97, X-PLOR 3.0
REMARK 3 AUTHORS : MSI (FELIX), BRUNGER (X-PLOR)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1EWI COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 26-APR-00.
REMARK 100 THE DEPOSITION ID IS D_1000010963.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298
REMARK 210 PH : 7.6
REMARK 210 IONIC STRENGTH : 50 MM
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 1MM D169, 100 MM TRIS, 100 MM
REMARK 210 TRIS-HCL, 0.25 MM EDTA, 50 MM
REMARK 210 NACL, 0.2% NAN3 AND 1MM DTT, PH
REMARK 210 7.6
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY; HNCACB;
REMARK 210 CBCACONNH
REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ; 750 MHZ
REMARK 210 SPECTROMETER MODEL : INOVA
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : X-PLOR 3.0
REMARK 210 METHOD USED : DISTANCE GEOMETRY/SIMULATED
REMARK 210 ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 8
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1
REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST
REMARK 210 RESTRAINT VIOLATIONS
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL
REMARK 210
REMARK 210 REMARK: DUE TO AGGREGATION DURING AGING, NMR SPECTRA WERE RECORDED
REMARK 210 WITH FRESHLY PREPARED SAMPLES.
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: 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 VAL A 2 84.38 -179.23
REMARK 500 GLN A 4 26.16 45.16
REMARK 500 LEU A 5 93.29 -37.04
REMARK 500 LYS A 22 59.68 -141.69
REMARK 500 PRO A 23 48.44 -82.71
REMARK 500 ILE A 24 30.08 -150.12
REMARK 500 ILE A 33 72.49 -109.73
REMARK 500 LEU A 50 -59.55 179.88
REMARK 500 LEU A 53 -71.03 -138.40
REMARK 500 SER A 54 41.07 71.68
REMARK 500 MET A 57 65.45 -150.06
REMARK 500 LEU A 58 55.62 -149.97
REMARK 500 ALA A 59 -135.14 -113.07
REMARK 500 ASN A 63 177.32 -48.70
REMARK 500 LEU A 71 57.35 179.29
REMARK 500 SER A 73 47.83 -162.24
REMARK 500 ASN A 74 64.57 83.09
REMARK 500 PHE A 82 142.56 178.60
REMARK 500 ARG A 92 156.99 -43.36
REMARK 500 MET A 97 -64.56 -106.71
REMARK 500 GLU A 100 76.88 -154.31
REMARK 500 VAL A 101 -158.56 -179.83
REMARK 500 LEU A 102 -29.41 -36.87
REMARK 500 SER A 104 43.26 164.99
REMARK 500 ALA A 105 44.42 -82.68
REMARK 500 VAL A 110 85.53 44.36
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: PLANAR GROUPS
REMARK 500
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS
REMARK 500 AN RMSD GREATER THAN THIS VALUE
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 M RES CSSEQI RMS TYPE
REMARK 500 ARG A 31 0.23 SIDE CHAIN
REMARK 500 ARG A 41 0.21 SIDE CHAIN
REMARK 500 ARG A 43 0.23 SIDE CHAIN
REMARK 500 ARG A 81 0.15 SIDE CHAIN
REMARK 500 ARG A 91 0.20 SIDE CHAIN
REMARK 500 ARG A 92 0.30 SIDE CHAIN
REMARK 500
REMARK 500 REMARK: NULL
DBREF 1EWI A 1 114 UNP P27694 RFA1_HUMAN 1 114
SEQRES 1 A 114 MET VAL GLY GLN LEU SER GLU GLY ALA ILE ALA ALA ILE
SEQRES 2 A 114 MET GLN LYS GLY ASP THR ASN ILE LYS PRO ILE LEU GLN
SEQRES 3 A 114 VAL ILE ASN ILE ARG PRO ILE THR THR GLY ASN SER PRO
SEQRES 4 A 114 PRO ARG TYR ARG LEU LEU MET SER ASP GLY LEU ASN THR
SEQRES 5 A 114 LEU SER SER PHE MET LEU ALA THR GLN LEU ASN PRO LEU
SEQRES 6 A 114 VAL GLU GLU GLU GLN LEU SER SER ASN CYS VAL CYS GLN
SEQRES 7 A 114 ILE HIS ARG PHE ILE VAL ASN THR LEU LYS ASP GLY ARG
SEQRES 8 A 114 ARG VAL VAL ILE LEU MET GLU LEU GLU VAL LEU LYS SER
SEQRES 9 A 114 ALA GLU ALA VAL GLY VAL LYS ILE GLY ASN
HELIX 1 1 GLY A 8 GLN A 15 1 8
HELIX 2 2 ALA A 59 ASN A 63 5 5
HELIX 3 3 LEU A 65 GLN A 70 1 6
SHEET 1 A 3 ARG A 41 SER A 47 0
SHEET 2 A 3 LEU A 25 ILE A 33 -1 N GLN A 26 O SER A 47
SHEET 3 A 3 VAL A 76 CYS A 77 -1 N CYS A 77 O LEU A 25
SHEET 1 B 2 PHE A 82 ASN A 85 0
SHEET 2 B 2 VAL A 93 LEU A 96 -1 O VAL A 93 N ASN A 85
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
Complete list - 16 20 Bytes