Header list of 1wic.pdb file
Complete list - r 2 2 Bytes
HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-MAY-04 1WIC TITLE SOLUTION STRUCTURE OF THE MSP DOMAIN OF RIKEN CDNA 6030424E15 COMPND MOL_ID: 1; COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN RIKEN CDNA 6030424E15; COMPND 3 CHAIN: A; COMPND 4 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 GENE: RIKEN CDNA 6030424E15; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P031215-09; SOURCE 8 OTHER_DETAILS: CELL FREE SYNTHESIS KEYWDS BETA SANDWICH FOLD, STRUCTURAL GENOMICS, RIKEN STRUCTURAL KEYWDS 2 GENOMICS/PROTEOMICS INITIATIVE, RSGI, UNKNOWN FUNCTION EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR H.ENDO,K.ASAKURA,N.NEMOTO,K.TAKASUGI,K.IZUMIE,M.YOSHIDA,F.HAYASHI, AUTHOR 2 S.YOKOYAMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI) REVDAT 3 02-MAR-22 1WIC 1 REMARK SEQADV REVDAT 2 24-FEB-09 1WIC 1 VERSN REVDAT 1 28-NOV-04 1WIC 0 JRNL AUTH H.ENDO,K.ASAKURA,N.NEMOTO,K.TAKASUGI,K.IZUMIE,M.YOSHIDA, JRNL AUTH 2 F.HAYASHI,S.YOKOYAMA JRNL TITL SOLUTION STRUCTURE OF THE MSP DOMAIN OF RIKEN CDNA JRNL TITL 2 6030424E15 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CYANA 1.0.7 REMARK 3 AUTHORS : GUENTERT, P. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1WIC COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 07-JUN-04. REMARK 100 THE DEPOSITION ID IS D_1000023611. 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 : 120 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.99MM 13C,15N-LABELED PROTEIN; REMARK 210 20MM TRIS-HCL BUFFER;100MM NACL; REMARK 210 1MM D10-DTT; 0.02% NAN3 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY; 3D_15N REMARK 210 -SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 900 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : VNMR 6.1C, NMRPIPE 2002045, REMARK 210 NMRVEW 5.0.4, KUJIRA 0.899, REMARK 210 CYANA 1.0.7 REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS, TARGET REMARK 210 FUNCTION 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: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 H ARG A 64 O SER A 83 1.49 REMARK 500 O LYS A 54 H MET A 99 1.50 REMARK 500 H ARG A 56 O LEU A 97 1.58 REMARK 500 O PRO A 122 H LYS A 125 1.59 REMARK 500 REMARK 500 REMARK: NULL 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 SER A 6 165.38 65.94 REMARK 500 1 LYS A 15 92.76 -58.28 REMARK 500 1 LEU A 18 -75.82 -120.18 REMARK 500 1 ALA A 24 -81.71 -64.75 REMARK 500 1 GLU A 26 104.60 -162.68 REMARK 500 1 SER A 34 30.75 -92.71 REMARK 500 1 LYS A 37 63.24 -115.73 REMARK 500 1 THR A 47 163.11 -49.02 REMARK 500 1 SER A 70 -171.02 -170.55 REMARK 500 1 LEU A 88 -165.09 -79.48 REMARK 500 1 ALA A 100 117.82 -162.42 REMARK 500 1 GLU A 104 -140.25 -60.99 REMARK 500 1 GLN A 105 -88.67 -80.36 REMARK 500 1 THR A 109 53.31 -142.10 REMARK 500 1 ALA A 112 -72.72 -92.52 REMARK 500 1 THR A 135 125.63 -38.72 REMARK 500 1 SER A 138 75.37 44.27 REMARK 500 1 LYS A 140 149.27 178.20 REMARK 500 1 ASN A 142 90.78 51.90 REMARK 500 1 SER A 143 141.95 62.38 REMARK 500 1 LEU A 144 -177.27 50.37 REMARK 500 1 LEU A 146 108.65 -167.70 REMARK 500 1 SER A 147 128.97 -176.13 REMARK 500 2 LYS A 9 155.20 -47.00 REMARK 500 2 LYS A 15 96.05 -58.84 REMARK 500 2 LEU A 18 -76.06 -116.84 REMARK 500 2 ALA A 24 -88.82 -60.65 REMARK 500 2 GLU A 26 103.17 -163.08 REMARK 500 2 ILE A 32 148.60 -39.84 REMARK 500 2 GLU A 33 -163.05 75.11 REMARK 500 2 GLU A 36 127.57 78.67 REMARK 500 2 LYS A 37 53.55 -142.54 REMARK 500 2 ILE A 50 145.86 -39.39 REMARK 500 2 ASN A 69 103.80 171.33 REMARK 500 2 SER A 70 -160.45 176.43 REMARK 500 2 HIS A 85 -97.61 38.09 REMARK 500 2 SER A 91 -165.12 44.72 REMARK 500 2 GLU A 104 -139.05 -61.18 REMARK 500 2 THR A 109 29.69 46.16 REMARK 500 2 GLU A 113 -38.81 -32.42 REMARK 500 2 LEU A 114 -70.91 -75.53 REMARK 500 2 SER A 115 -30.01 -39.06 REMARK 500 2 THR A 135 -162.68 -161.73 REMARK 500 2 SER A 138 166.72 69.60 REMARK 500 2 SER A 139 149.50 63.74 REMARK 500 2 ASN A 142 -52.53 -131.64 REMARK 500 2 SER A 143 159.01 58.34 REMARK 500 2 SER A 151 -59.08 -138.06 REMARK 500 3 LYS A 15 93.69 -57.20 REMARK 500 3 LEU A 18 -76.43 -120.67 REMARK 500 REMARK 500 THIS ENTRY HAS 501 RAMACHANDRAN OUTLIERS. REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: MMT007115554.1 RELATED DB: TARGETDB DBREF 1WIC A 8 146 UNP Q9CWP6 MSPD2_MOUSE 317 455 SEQADV 1WIC GLY A 1 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 2 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 3 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC GLY A 4 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 5 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 6 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC GLY A 7 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 147 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC GLY A 148 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC PRO A 149 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 150 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC SER A 151 UNP Q9CWP6 CLONING ARTIFACT SEQADV 1WIC GLY A 152 UNP Q9CWP6 CLONING ARTIFACT SEQRES 1 A 152 GLY SER SER GLY SER SER GLY LYS LYS PRO LEU SER VAL SEQRES 2 A 152 PHE LYS GLY PRO LEU LEU HIS ILE SER PRO ALA GLU GLU SEQRES 3 A 152 LEU TYR PHE GLY SER ILE GLU SER GLY GLU LYS LYS THR SEQRES 4 A 152 LEU ILE VAL LEU THR ASN VAL THR LYS ASN ILE VAL ALA SEQRES 5 A 152 PHE LYS VAL ARG THR THR ALA PRO GLU LYS TYR ARG VAL SEQRES 6 A 152 LYS PRO SER ASN SER SER CYS ASP PRO GLY ALA SER ILE SEQRES 7 A 152 ASP ILE ILE VAL SER PRO HIS GLY GLY LEU THR VAL SER SEQRES 8 A 152 ALA GLN ASP ARG PHE LEU ILE MET ALA ALA GLU MET GLU SEQRES 9 A 152 GLN SER SER GLY THR GLY PRO ALA GLU LEU SER GLN PHE SEQRES 10 A 152 TRP LYS GLU VAL PRO ARG ASN LYS VAL MET GLU HIS ARG SEQRES 11 A 152 LEU ARG CYS HIS THR VAL GLU SER SER LYS PRO ASN SER SEQRES 12 A 152 LEU MET LEU SER GLY PRO SER SER GLY HELIX 1 1 GLY A 110 VAL A 121 1 12 SHEET 1 A 3 THR A 39 THR A 44 0 SHEET 2 A 3 SER A 77 PRO A 84 -1 O ILE A 80 N ILE A 41 SHEET 3 A 3 TYR A 63 LYS A 66 -1 N ARG A 64 O SER A 83 SHEET 1 B 4 ASN A 69 CYS A 72 0 SHEET 2 B 4 VAL A 51 THR A 57 -1 N VAL A 51 O CYS A 72 SHEET 3 B 4 PHE A 96 GLU A 102 -1 O MET A 99 N LYS A 54 SHEET 4 B 4 MET A 127 LEU A 131 -1 O LEU A 131 N PHE A 96 CISPEP 1 SER A 22 PRO A 23 1 0.02 CISPEP 2 LYS A 66 PRO A 67 1 -0.10 CISPEP 3 SER A 22 PRO A 23 2 0.05 CISPEP 4 LYS A 66 PRO A 67 2 0.02 CISPEP 5 SER A 22 PRO A 23 3 -0.03 CISPEP 6 LYS A 66 PRO A 67 3 0.00 CISPEP 7 SER A 22 PRO A 23 4 0.01 CISPEP 8 LYS A 66 PRO A 67 4 -0.08 CISPEP 9 SER A 22 PRO A 23 5 0.00 CISPEP 10 LYS A 66 PRO A 67 5 -0.06 CISPEP 11 SER A 22 PRO A 23 6 0.02 CISPEP 12 LYS A 66 PRO A 67 6 0.05 CISPEP 13 SER A 22 PRO A 23 7 0.04 CISPEP 14 LYS A 66 PRO A 67 7 0.03 CISPEP 15 SER A 22 PRO A 23 8 0.05 CISPEP 16 LYS A 66 PRO A 67 8 -0.03 CISPEP 17 SER A 22 PRO A 23 9 -0.03 CISPEP 18 LYS A 66 PRO A 67 9 0.00 CISPEP 19 SER A 22 PRO A 23 10 -0.05 CISPEP 20 LYS A 66 PRO A 67 10 0.03 CISPEP 21 SER A 22 PRO A 23 11 0.03 CISPEP 22 LYS A 66 PRO A 67 11 0.06 CISPEP 23 SER A 22 PRO A 23 12 0.00 CISPEP 24 LYS A 66 PRO A 67 12 0.00 CISPEP 25 SER A 22 PRO A 23 13 -0.01 CISPEP 26 LYS A 66 PRO A 67 13 0.05 CISPEP 27 SER A 22 PRO A 23 14 -0.06 CISPEP 28 LYS A 66 PRO A 67 14 0.04 CISPEP 29 SER A 22 PRO A 23 15 -0.01 CISPEP 30 LYS A 66 PRO A 67 15 0.07 CISPEP 31 SER A 22 PRO A 23 16 -0.09 CISPEP 32 LYS A 66 PRO A 67 16 0.02 CISPEP 33 SER A 22 PRO A 23 17 -0.10 CISPEP 34 LYS A 66 PRO A 67 17 -0.04 CISPEP 35 SER A 22 PRO A 23 18 0.01 CISPEP 36 LYS A 66 PRO A 67 18 -0.03 CISPEP 37 SER A 22 PRO A 23 19 -0.05 CISPEP 38 LYS A 66 PRO A 67 19 -0.04 CISPEP 39 SER A 22 PRO A 23 20 0.03 CISPEP 40 LYS A 66 PRO A 67 20 0.05 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 2 2 Bytes