Header list of 1p0r.pdb file
Complete list - 23 20 Bytes
HEADER PROTEIN BINDING 10-APR-03 1P0R
TITLE SOLUTION STRUCTURE OF UBL5 A HUMAN UBIQUITIN-LIKE PROTEIN
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: UBIQUITIN-LIKE 5;
COMPND 3 CHAIN: A;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 3 ORGANISM_COMMON: HUMAN;
SOURCE 4 ORGANISM_TAXID: 9606;
SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);
SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008;
SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET15B
KEYWDS UBIQUITIN-LIKE FOLD, PROTEIN BINDING
EXPDTA SOLUTION NMR
MDLTYP MINIMIZED AVERAGE
AUTHOR T.MCNALLY,Q.HUANG,R.S.JANIS,Z.LIU,E.T.OLEJNICZAK,R.M.REILLY
REVDAT 3 23-FEB-22 1P0R 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1P0R 1 VERSN
REVDAT 1 28-OCT-03 1P0R 0
JRNL AUTH T.MCNALLY,Q.HUANG,R.S.JANIS,Z.LIU,E.T.OLEJNICZAK,R.M.REILLY
JRNL TITL STRUCTURAL ANALYSIS OF UBL5, A NOVEL UBIQUITIN-LIKE MODIFIER
JRNL REF PROTEIN SCI. V. 12 1562 2003
JRNL REFN ISSN 0961-8368
JRNL PMID 12824502
JRNL DOI 10.1110/PS.0382803
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : CNX 2000
REMARK 3 AUTHORS : BRUNGER, A.T.
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: BASED ON 952 NMR-DERIVED DISTANCE AND
REMARK 3 TORSION ANGLE RESTRAINTS.
REMARK 4
REMARK 4 1P0R COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-APR-03.
REMARK 100 THE DEPOSITION ID IS D_1000018874.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298
REMARK 210 PH : 5.7
REMARK 210 IONIC STRENGTH : 50MM SODIUM PHOSPHATE
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : .5MM UBL5 U-15N,13C 50MM SODIUM
REMARK 210 PHOSPHATE (PH 5.7), 2MM DTT;
REMARK 210 1.0MM UBL5 U-15N,13C 50MM SODIUM
REMARK 210 PHOSPHATE (PH 5.7), 2MM DTT
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY; 3D_13C
REMARK 210 -SEPARATED_NOESY
REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 600 MHZ
REMARK 210 SPECTROMETER MODEL : DRX
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NULL
REMARK 210 METHOD USED : SIMULATED ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1
REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1
REMARK 210
REMARK 210 REMARK: NULL
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 465
REMARK 465 MISSING RESIDUES
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
REMARK 465 RES C SSSEQI
REMARK 465 MET A -19
REMARK 465 GLY A -18
REMARK 465 SER A -17
REMARK 465 SER A -16
REMARK 465 HIS A -15
REMARK 465 HIS A -14
REMARK 465 HIS A -13
REMARK 465 HIS A -12
REMARK 465 HIS A -11
REMARK 465 HIS A -10
REMARK 465 SER A -9
REMARK 465 SER A -8
REMARK 465 GLY A -7
REMARK 465 LEU A -6
REMARK 465 VAL A -5
REMARK 465 PRO A -4
REMARK 465 ARG A -3
REMARK 465 GLY A -2
REMARK 465 SER A -1
REMARK 465 HIS A 0
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 CYS A 18 -149.45 -145.96
REMARK 500 ALA A 33 42.19 -95.11
REMARK 500 GLN A 34 -57.56 -151.91
REMARK 500 ARG A 38 176.71 63.42
REMARK 500 ASN A 40 -58.28 -120.96
REMARK 500 TRP A 47 -64.40 74.82
REMARK 500 TYR A 48 67.09 171.94
REMARK 500 SER A 56 61.30 -154.37
REMARK 500 GLU A 61 84.45 51.70
REMARK 500
REMARK 500 REMARK: NULL
DBREF 1P0R A 1 73 UNP Q9BZL1 UBL5_HUMAN 1 73
SEQADV 1P0R MET A -19 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R GLY A -18 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R SER A -17 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R SER A -16 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -15 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -14 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -13 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -12 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -11 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A -10 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R SER A -9 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R SER A -8 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R GLY A -7 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R LEU A -6 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R VAL A -5 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R PRO A -4 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R ARG A -3 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R GLY A -2 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R SER A -1 UNP Q9BZL1 EXPRESSION TAG
SEQADV 1P0R HIS A 0 UNP Q9BZL1 EXPRESSION TAG
SEQRES 1 A 93 MET GLY SER SER HIS HIS HIS HIS HIS HIS SER SER GLY
SEQRES 2 A 93 LEU VAL PRO ARG GLY SER HIS MET ILE GLU VAL VAL CYS
SEQRES 3 A 93 ASN ASP ARG LEU GLY LYS LYS VAL ARG VAL LYS CYS ASN
SEQRES 4 A 93 THR ASP ASP THR ILE GLY ASP LEU LYS LYS LEU ILE ALA
SEQRES 5 A 93 ALA GLN THR GLY THR ARG TRP ASN LYS ILE VAL LEU LYS
SEQRES 6 A 93 LYS TRP TYR THR ILE PHE LYS ASP HIS VAL SER LEU GLY
SEQRES 7 A 93 ASP TYR GLU ILE HIS ASP GLY MET ASN LEU GLU LEU TYR
SEQRES 8 A 93 TYR GLN
HELIX 1 1 THR A 23 ALA A 33 1 11
SHEET 1 A 4 LYS A 12 CYS A 18 0
SHEET 2 A 4 ILE A 2 ASP A 8 -1 N ASP A 8 O LYS A 12
SHEET 3 A 4 MET A 66 TYR A 71 1 O MET A 66 N VAL A 5
SHEET 4 A 4 VAL A 43 LYS A 45 -1 N VAL A 43 O TYR A 71
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 - 23 20 Bytes