Header list of 2cqa.pdb file
Complete list - r 9 2 Bytes
HEADER HYDROLASE 19-MAY-05 2CQA TITLE SOLUTION STRUCTURE OF RSGI RUH-039, A FRAGMENT OF C-TERMINAL DOMAIN OF TITLE 2 RUVB-LIKE 2 FROM HUMAN CDNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: RUVB-LIKE 2; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: C-TERMINAL DOMAIN (RESIDUES 132-213); COMPND 5 SYNONYM: 48-KDA TATA BOX-BINDING PROTEIN-INTERACTING PROTEIN, 48-KDA COMPND 6 TBP-INTERACTING PROTEIN, TIP49B, REPRESSING PONTIN 52, REPTIN 52, 51 COMPND 7 KDA ERYTHROCYTE CYTOSOLIC PROTEIN, ECP-51, TIP60-ASSOCIATED PROTEIN COMPND 8 54-BETA, TAP54-BETA, CGI-46; COMPND 9 EC: 3.6.1.-; COMPND 10 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: RUVBL2, TIP48, TIP49B; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P041004-05; SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS KEYWDS RUVB LIKE 2, TIP48, TIP49B, REPTIN 52, ECP-51, TAP54-BETA, STRUCTURAL KEYWDS 2 GENOMICS, NPPSFA, NATIONAL PROJECT ON PROTEIN STRUCTURAL AND KEYWDS 3 FUNCTIONAL ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS KEYWDS 4 INITIATIVE, RSGI, HYDROLASE EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR T.ABE,H.HIROTA,K.SAITO,S.KOSHIBA,T.KIGAWA,S.YOKOYAMA,RIKEN STRUCTURAL AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI) REVDAT 3 09-MAR-22 2CQA 1 REMARK SEQADV REVDAT 2 24-FEB-09 2CQA 1 VERSN REVDAT 1 19-NOV-05 2CQA 0 JRNL AUTH T.ABE,H.HIROTA,K.SAITO,S.KOSHIBA,T.KIGAWA,S.YOKOYAMA JRNL TITL SOLUTION STRUCTURE OF RSGI RUH-039, A FRAGMENT OF C-TERMINAL JRNL TITL 2 DOMAIN OF RUVB-LIKE 2 FROM HUMAN CDNA JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : XWINNMR 3.5, CYANA 2.0.17 REMARK 3 AUTHORS : BRUKER (XWINNMR), GUNTERT, P. (CYANA) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2CQA COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 24-MAY-05. REMARK 100 THE DEPOSITION ID IS D_1000024501. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 7.0 REMARK 210 IONIC STRENGTH : 120MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1.3MM RSGI RUH-039 U-15,13C; REMARK 210 20MM D-TRIS-HCL; 100MM NACL; 1MM REMARK 210 D-DTT; 0.02% NAN3; 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY; 3D_13C REMARK 210 -SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE 20031121, NMRVIEW 5.0.4, REMARK 210 KUJIRA 0.9295 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION, STRUCTURES WITH REMARK 210 THE LOWEST ENERGY, STRUCTURES REMARK 210 WITH THE LEAST RESTRAINT REMARK 210 VIOLATIONS 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 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 GLU A 9 35.43 -87.60 REMARK 500 1 GLU A 12 35.46 -91.57 REMARK 500 1 VAL A 18 98.19 -41.44 REMARK 500 1 GLU A 43 25.01 48.17 REMARK 500 2 GLU A 12 34.90 -87.79 REMARK 500 2 GLU A 43 25.03 48.10 REMARK 500 2 THR A 52 -50.05 -121.66 REMARK 500 3 GLU A 10 142.39 -170.74 REMARK 500 3 ALA A 27 168.33 -45.82 REMARK 500 3 THR A 28 107.25 -34.67 REMARK 500 3 GLU A 43 25.76 47.36 REMARK 500 3 SER A 84 145.32 -174.81 REMARK 500 3 SER A 94 87.70 -58.28 REMARK 500 4 GLU A 10 135.61 -174.02 REMARK 500 4 VAL A 18 106.89 -43.04 REMARK 500 4 GLU A 43 25.29 48.15 REMARK 500 5 SER A 3 176.89 -53.02 REMARK 500 5 LYS A 8 81.00 -57.26 REMARK 500 5 GLU A 12 33.67 -87.29 REMARK 500 5 VAL A 18 108.95 -52.74 REMARK 500 5 PRO A 26 2.33 -69.69 REMARK 500 5 THR A 30 -74.41 -34.30 REMARK 500 5 LYS A 33 136.45 -174.03 REMARK 500 5 THR A 42 116.03 -37.62 REMARK 500 5 GLU A 43 41.22 31.79 REMARK 500 5 LYS A 62 47.90 38.03 REMARK 500 5 PRO A 92 88.61 -69.75 REMARK 500 5 SER A 94 91.74 -55.45 REMARK 500 6 GLU A 9 114.61 -168.88 REMARK 500 6 GLU A 10 101.25 -59.88 REMARK 500 6 GLU A 12 30.50 -86.21 REMARK 500 6 THR A 42 111.34 -37.81 REMARK 500 6 GLU A 43 42.07 34.45 REMARK 500 7 SER A 2 107.82 -39.26 REMARK 500 7 GLU A 12 35.93 -86.65 REMARK 500 7 VAL A 18 108.14 -46.59 REMARK 500 7 GLU A 43 -76.91 -113.91 REMARK 500 7 LYS A 62 51.46 36.59 REMARK 500 7 ALA A 88 119.54 -170.20 REMARK 500 7 PRO A 92 99.50 -69.75 REMARK 500 7 SER A 94 106.23 -42.69 REMARK 500 8 SER A 6 145.81 -35.47 REMARK 500 8 GLU A 9 45.88 35.26 REMARK 500 8 GLU A 10 46.66 -109.43 REMARK 500 8 THR A 11 43.00 37.90 REMARK 500 8 GLU A 12 35.25 -83.86 REMARK 500 8 THR A 42 109.25 -33.31 REMARK 500 8 GLU A 43 48.04 35.66 REMARK 500 8 GLU A 56 -27.07 -39.73 REMARK 500 8 SER A 93 -72.31 -43.26 REMARK 500 REMARK 500 THIS ENTRY HAS 135 RAMACHANDRAN OUTLIERS. REMARK 500 REMARK 500 REMARK: NULL REMARK 700 REMARK 700 SHEET REMARK 700 DETERMINATION METHOD: AUTHOR DETERMINED REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: HSS001000001.1 RELATED DB: TARGETDB DBREF 2CQA A 8 89 UNP Q9Y230 RUVB2_HUMAN 131 212 SEQADV 2CQA GLY A 1 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 2 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 3 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA GLY A 4 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 5 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 6 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA GLY A 7 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 90 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA GLY A 91 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA PRO A 92 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 93 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA SER A 94 UNP Q9Y230 CLONING ARTIFACT SEQADV 2CQA GLY A 95 UNP Q9Y230 CLONING ARTIFACT SEQRES 1 A 95 GLY SER SER GLY SER SER GLY LYS GLU GLU THR GLU ILE SEQRES 2 A 95 ILE GLU GLY GLU VAL VAL GLU ILE GLN ILE ASP ARG PRO SEQRES 3 A 95 ALA THR GLY THR GLY SER LYS VAL GLY LYS LEU THR LEU SEQRES 4 A 95 LYS THR THR GLU MET GLU THR ILE TYR ASP LEU GLY THR SEQRES 5 A 95 LYS MET ILE GLU SER LEU THR LYS ASP LYS VAL GLN ALA SEQRES 6 A 95 GLY ASP VAL ILE THR ILE ASP LYS ALA THR GLY LYS ILE SEQRES 7 A 95 SER LYS LEU GLY ARG SER PHE THR ARG ALA ARG SER GLY SEQRES 8 A 95 PRO SER SER GLY HELIX 1 1 THR A 52 ASP A 61 1 10 SHEET 1 A 5 MET A 44 LEU A 50 0 SHEET 2 A 5 VAL A 34 THR A 41 -1 N LEU A 37 O TYR A 48 SHEET 3 A 5 ILE A 13 ASP A 24 -1 N GLN A 22 O LYS A 36 SHEET 4 A 5 VAL A 68 ASP A 72 -1 O ILE A 69 N GLY A 16 SHEET 5 A 5 LYS A 77 GLY A 82 -1 O LYS A 77 N ASP A 72 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 - r 9 2 Bytes