Header list of 1e0l.pdb file
Complete list - 25 20 Bytes
HEADER SH3 DOMAIN 30-MAR-00 1E0L TITLE FBP28WW DOMAIN FROM MUS MUSCULUS COMPND MOL_ID: 1; COMPND 2 MOLECULE: FORMIN BINDING PROTEIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: DOMAIN; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 3 ORGANISM_COMMON: HOUSE MOUSE; SOURCE 4 ORGANISM_TAXID: 10090; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS SH3 DOMAIN, WW DOMAIN, FBP28, SIGNAL TRANSDUCTION EXPDTA SOLUTION NMR NUMMDL 10 AUTHOR M.J.MACIAS,V.GERVAIS,C.CIVERA,H.OSCHKINAT REVDAT 2 24-FEB-09 1E0L 1 VERSN REVDAT 1 20-APR-00 1E0L 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 1E0L 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-4803. 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 : 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 210 SPECTROSCOPY 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 ALA A 2 120.95 -171.97 REMARK 500 1 VAL A 5 85.72 44.62 REMARK 500 1 SER A 6 -172.06 170.62 REMARK 500 1 GLN A 34 36.11 31.10 REMARK 500 1 GLU A 35 24.15 -153.85 REMARK 500 2 ALA A 2 97.57 52.14 REMARK 500 2 THR A 3 58.10 -114.10 REMARK 500 2 VAL A 5 128.79 64.23 REMARK 500 2 SER A 6 -160.15 81.97 REMARK 500 2 GLN A 34 59.29 -68.71 REMARK 500 2 GLU A 35 30.94 -178.32 REMARK 500 2 LEU A 36 58.63 -151.74 REMARK 500 3 THR A 3 68.98 -119.66 REMARK 500 3 ALA A 4 49.53 -108.04 REMARK 500 3 VAL A 5 81.64 42.89 REMARK 500 3 SER A 6 -166.71 171.32 REMARK 500 3 ARG A 24 -30.78 -38.63 REMARK 500 3 GLN A 34 57.91 -67.13 REMARK 500 3 GLU A 35 31.08 -176.27 REMARK 500 3 LEU A 36 51.60 -154.24 REMARK 500 4 ALA A 2 114.47 68.67 REMARK 500 4 ALA A 4 50.28 -111.21 REMARK 500 4 VAL A 5 136.98 59.43 REMARK 500 4 SER A 6 -162.21 78.83 REMARK 500 4 ARG A 24 -31.12 -39.77 REMARK 500 4 GLN A 34 59.97 -68.48 REMARK 500 4 GLU A 35 31.29 -177.40 REMARK 500 4 LEU A 36 41.62 -148.56 REMARK 500 5 ALA A 2 132.59 -177.93 REMARK 500 5 ALA A 4 50.78 -110.83 REMARK 500 5 VAL A 5 81.72 46.50 REMARK 500 5 SER A 6 -170.77 166.72 REMARK 500 5 GLN A 34 59.62 -68.54 REMARK 500 5 GLU A 35 31.69 -177.82 REMARK 500 5 LEU A 36 48.63 -152.76 REMARK 500 6 ALA A 2 -76.07 -179.82 REMARK 500 6 THR A 3 72.06 -158.93 REMARK 500 6 ALA A 4 50.07 -106.45 REMARK 500 6 VAL A 5 77.94 55.44 REMARK 500 6 SER A 6 -162.47 167.71 REMARK 500 6 GLU A 35 32.66 -176.37 REMARK 500 6 LEU A 36 45.52 -151.05 REMARK 500 7 ALA A 2 94.30 -166.05 REMARK 500 7 ALA A 4 50.60 -98.18 REMARK 500 7 VAL A 5 129.22 61.02 REMARK 500 7 SER A 6 -91.37 66.75 REMARK 500 7 GLU A 7 30.57 36.00 REMARK 500 7 GLN A 34 35.35 30.54 REMARK 500 7 GLU A 35 24.62 -156.80 REMARK 500 8 ALA A 2 46.11 -153.85 REMARK 500 8 THR A 3 45.36 -97.75 REMARK 500 8 ALA A 4 50.95 -96.69 REMARK 500 8 VAL A 5 81.85 65.01 REMARK 500 8 SER A 6 -167.14 175.55 REMARK 500 8 GLN A 34 59.33 -68.81 REMARK 500 8 GLU A 35 32.07 -177.25 REMARK 500 8 LEU A 36 60.78 -153.35 REMARK 500 9 ALA A 2 121.09 62.14 REMARK 500 9 THR A 3 76.53 -150.62 REMARK 500 9 ALA A 4 48.49 -98.43 REMARK 500 9 VAL A 5 86.95 65.36 REMARK 500 9 SER A 6 -159.85 171.34 REMARK 500 9 PRO A 33 49.93 -84.62 REMARK 500 9 GLN A 34 37.28 30.91 REMARK 500 9 GLU A 35 25.05 -154.69 REMARK 500 10 THR A 3 73.37 -161.11 REMARK 500 10 ALA A 4 49.21 -107.45 REMARK 500 10 VAL A 5 81.94 63.31 REMARK 500 10 SER A 6 -166.62 167.62 REMARK 500 10 GLN A 34 35.96 31.27 REMARK 500 10 GLU A 35 23.86 -154.17 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 1 ARG A 24 0.23 SIDE CHAIN REMARK 500 2 ARG A 24 0.23 SIDE CHAIN REMARK 500 3 ARG A 24 0.23 SIDE CHAIN REMARK 500 4 ARG A 24 0.12 SIDE CHAIN REMARK 500 5 ARG A 24 0.12 SIDE CHAIN REMARK 500 6 ARG A 24 0.31 SIDE CHAIN REMARK 500 7 ARG A 24 0.24 SIDE CHAIN REMARK 500 8 ARG A 24 0.31 SIDE CHAIN REMARK 500 9 ARG A 24 0.30 SIDE CHAIN REMARK 500 10 ARG A 24 0.24 SIDE CHAIN 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: 1E0N RELATED DB: PDB REMARK 900 YJQ8WW DOMAIN FROM SACCHAROMYCES CEREVISAE REMARK 900 RELATED ID: 4714 RELATED DB: BMRB REMARK 900 NMR RESTRAINTS FOR THE ENTRY 1E0L DBREF 1E0L A 1 37 UNP Q61051 Q61051 1 26 SEQRES 1 A 37 GLY ALA THR ALA VAL SER GLU TRP THR GLU TYR LYS THR SEQRES 2 A 37 ALA ASP GLY LYS THR TYR TYR TYR ASN ASN ARG THR LEU SEQRES 3 A 37 GLU SER THR TRP GLU LYS PRO GLN GLU LEU LYS SHEET 1 A 3 TRP A 8 THR A 13 0 SHEET 2 A 3 LYS A 17 ASN A 23 -1 O TYR A 19 N TYR A 11 SHEET 3 A 3 LEU A 26 TRP A 30 -1 O GLU A 27 N ASN A 22 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