Header list of 1e0n.pdb file
Complete list - 25 20 Bytes
HEADER YJQ8WW DOMAIN 01-APR-00 1E0N
TITLE YJQ8WW DOMAIN FROM SACCHAROMYCES CEREVISAE
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: DOMAIN;
COMPND 5 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;
SOURCE 3 ORGANISM_TAXID: 4932;
SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562
KEYWDS YJQ8WW DOMAIN, WW DOMAIN, SACCHAROMYCES CEREVISAE, YJQ8
KEYWDS 2 PROTEIN
EXPDTA SOLUTION NMR
NUMMDL 10
AUTHOR M.J.MACIAS,V.GERVAIS,C.CIVERA,H.OSCHKINAT
REVDAT 3 24-FEB-09 1E0N 1 VERSN
REVDAT 2 09-JUN-00 1E0N 1 ENDMDL
REVDAT 1 02-JUN-00 1E0N 0
JRNL AUTH M.J.MACIAS,V.GERVAIS,C.CIVERA,H.OSCHKINAT
JRNL TITL STRUCTURAL ANALYSIS OF WW DOMAINS AND DESIGN OF A
JRNL TITL 2 WW PROTOTYPE
JRNL REF NAT.STRUCT.BIOL. V. 7 375 2000
JRNL REFN ISSN 1072-8368
JRNL PMID 10802733
JRNL DOI 10.1038/75144
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : ARIA/CNS
REMARK 3 AUTHORS : 1. NILGES, M.
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1E0N COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 03-APR-00.
REMARK 100 THE PDBE ID CODE IS EBI-4807.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 285
REMARK 210 PH : 6.5
REMARK 210 IONIC STRENGTH : NULL
REMARK 210 PRESSURE : NULL
REMARK 210 SAMPLE CONTENTS : NULL
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY; TOCSY
REMARK 210 SPECTROMETER FIELD STRENGTH : 600
REMARK 210 SPECTROMETER MODEL : DRX 600
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : XEASY/ARIA/CNS
REMARK 210 METHOD USED : SIMULATED ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 20
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 10
REMARK 210 CONFORMERS, SELECTION CRITERIA : LOWEST ENERGY
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1
REMARK 210
REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING HOMONUCLEAR NMR
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 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 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 GLU A 10 -152.40 -142.28
REMARK 500 1 GLU A 14 -68.03 -96.67
REMARK 500 1 ASN A 22 119.45 -172.36
REMARK 500 1 LEU A 29 -173.94 -177.66
REMARK 500 2 GLU A 10 -157.62 -138.20
REMARK 500 2 ASN A 22 123.75 -175.34
REMARK 500 3 GLU A 10 -157.08 -135.04
REMARK 500 3 PRO A 18 90.85 -62.12
REMARK 500 3 LEU A 29 -176.43 176.57
REMARK 500 3 TYR A 31 147.32 -171.02
REMARK 500 4 GLU A 10 -156.09 -153.35
REMARK 500 4 ASN A 22 130.40 -172.08
REMARK 500 4 LYS A 26 82.50 75.88
REMARK 500 4 PRO A 32 166.73 -47.91
REMARK 500 5 PRO A 18 138.65 -32.20
REMARK 500 5 ASN A 22 119.40 -173.51
REMARK 500 5 PRO A 32 168.90 -49.13
REMARK 500 6 GLU A 10 -155.84 -145.84
REMARK 500 6 ILE A 12 -156.40 -136.44
REMARK 500 6 ASN A 22 124.28 -172.78
REMARK 500 7 GLU A 10 -154.38 -136.35
REMARK 500 7 PRO A 18 96.32 -63.94
REMARK 500 7 ASN A 22 120.01 -177.36
REMARK 500 7 LEU A 29 -170.40 178.37
REMARK 500 7 HIS A 30 -51.57 -126.54
REMARK 500 8 GLU A 10 -159.45 -137.82
REMARK 500 8 PRO A 18 90.31 -65.18
REMARK 500 8 ASN A 22 126.64 -172.58
REMARK 500 8 LYS A 26 71.31 59.80
REMARK 500 8 LEU A 29 -171.99 -175.86
REMARK 500 9 GLU A 10 -159.71 -138.06
REMARK 500 9 GLU A 14 -57.11 -123.55
REMARK 500 9 PRO A 18 93.98 -66.83
REMARK 500 9 ASN A 22 120.52 -175.25
REMARK 500 9 LEU A 29 -167.79 -178.78
REMARK 500 9 HIS A 30 -50.86 -133.04
REMARK 500 10 GLU A 10 -152.55 -134.95
REMARK 500 10 PRO A 18 98.56 -66.01
REMARK 500 10 ASN A 22 120.62 -175.17
REMARK 500 10 LEU A 29 171.12 179.26
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 1E0M RELATED DB: PDB
REMARK 900 PROTOTYPE WW DOMAIN
REMARK 900 RELATED ID: 1E0L RELATED DB: PDB
REMARK 900 FBP28WW DOMAIN FROM MUS MUSCULUS
REMARK 900 RELATED ID: 4715 RELATED DB: BMRB
REMARK 900 NMR RESTRAINTS FOR ENTRY 1E0N
DBREF 1E0N A 7 33 PDB 1E0N 1E0N 7 33
SEQRES 1 A 27 PRO GLY TRP GLU ILE ILE HIS GLU ASN GLY ARG PRO LEU
SEQRES 2 A 27 TYR TYR ASN ALA GLU GLN LYS THR LYS LEU HIS TYR PRO
SEQRES 3 A 27 PRO
SHEET 1 A 3 TRP A 9 GLU A 14 0
SHEET 2 A 3 ARG A 17 ALA A 23 -1 O LEU A 19 N ILE A 12
SHEET 3 A 3 LYS A 26 HIS A 30 -1 O THR A 27 N ASN A 22
CISPEP 1 PRO A 32 PRO A 33 7 1.86
CISPEP 2 TYR A 31 PRO A 32 9 -1.85
CISPEP 3 TYR A 31 PRO A 32 10 -3.11
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 - 25 20 Bytes