HEADER TRANSCRIPTION 10-JUL-03 1UHS
TITLE SOLUTION STRUCTURE OF MOUSE HOMEODOMAIN-ONLY PROTEIN HOP
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: HOMEODOMAIN ONLY PROTEIN;
COMPND 3 CHAIN: A;
COMPND 4 SYNONYM: HOP;
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 GENE: RIKEN CDNA 1110018K11;
SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P021021-01;
SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS
KEYWDS STRUCTURAL GENOMICS, CARDIAC DEVELOPMENT, RIKEN STRUCTURAL
KEYWDS 2 GENOMICS/PROTEOMICS INITIATIVE, RSGI, TRANSCRIPTION
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR K.SAITO,S.KOSHIBA,M.INOUE,M.SHIROUZU,T.TERADA,T.YABUKI,M.AOKI,
AUTHOR 2 T.MATSUDA,E.SEKI,H.HIROTA,M.YOSHIDA,A.TANAKA,T.OSANAI,T.ARAKAWA,
AUTHOR 3 P.CARNINCI,J.KAWAI,Y.HAYASHIZAKI,T.KIGAWA,S.YOKOYAMA,RIKEN
AUTHOR 4 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)
REVDAT 4 27-DEC-23 1UHS 1 REMARK
REVDAT 3 02-MAR-22 1UHS 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1UHS 1 VERSN
REVDAT 1 10-JUL-04 1UHS 0
JRNL AUTH K.SAITO,S.KOSHIBA,M.INOUE,M.SHIROUZU,T.TERADA,T.YABUKI,
JRNL AUTH 2 M.AOKI,T.MATSUDA,E.SEKI,H.HIROTA,M.YOSHIDA,A.TANAKA,
JRNL AUTH 3 T.OSANAI,T.ARAKAWA,P.CARNINCI,J.KAWAI,Y.HAYASHIZAKI,
JRNL AUTH 4 T.KIGAWA,S.YOKOYAMA
JRNL TITL SOLUTION STRUCTURE OF MOUSE HOMEODOMAIN-ONLY PROTEIN HOP
JRNL REF TO BE PUBLISHED
JRNL REFN
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : CNS 1.1
REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE
REMARK 3 -KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,READ,RICE,
REMARK 3 SIMONSON,WARREN
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1UHS COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 11-JUL-03.
REMARK 100 THE DEPOSITION ID IS D_1000005842.
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 : 20MM D-TRIS-HCL (PH 7.0), 100MM
REMARK 210 NACL, 1MM D-DTT, 0.02% NAN3
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 : XWINNMR 2.6, NMRPIPE 20020425,
REMARK 210 NMRVIEW 5, CNS 1.1
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 LOWEST
REMARK 210 ENERGY
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 VAL A 23 -70.88 -155.34
REMARK 500 1 ASN A 24 -177.20 -177.78
REMARK 500 1 HIS A 26 63.43 -117.94
REMARK 500 1 PRO A 64 -167.94 -69.46
REMARK 500 2 GLU A 3 88.58 60.53
REMARK 500 2 VAL A 23 -70.52 -91.96
REMARK 500 2 HIS A 26 61.56 -119.61
REMARK 500 2 PRO A 64 -177.68 -66.89
REMARK 500 2 GLU A 66 93.99 -68.74
REMARK 500 2 ARG A 68 -73.05 -71.13
REMARK 500 3 GLU A 3 82.32 -64.20
REMARK 500 3 ALA A 6 171.20 60.48
REMARK 500 3 VAL A 23 -69.83 -155.47
REMARK 500 3 PRO A 27 -176.16 -67.64
REMARK 500 3 SER A 65 147.60 62.41
REMARK 500 3 GLU A 66 -68.64 -101.80
REMARK 500 3 THR A 71 98.34 -63.05
REMARK 500 4 SER A 2 -177.60 60.57
REMARK 500 4 GLU A 3 -62.83 -129.30
REMARK 500 4 THR A 7 169.33 60.62
REMARK 500 4 VAL A 23 -70.22 -155.67
REMARK 500 4 HIS A 26 70.74 -117.89
REMARK 500 4 SER A 65 99.28 -177.02
REMARK 500 4 CYS A 67 -73.16 -121.04
REMARK 500 5 ALA A 5 104.51 60.58
REMARK 500 5 HIS A 26 66.75 -118.06
REMARK 500 5 SER A 69 -174.60 -65.03
REMARK 500 6 GLU A 3 99.69 60.33
REMARK 500 6 THR A 7 167.31 60.40
REMARK 500 6 VAL A 23 -69.76 -155.64
REMARK 500 6 HIS A 26 63.61 -119.72
REMARK 500 6 SER A 65 -165.86 60.48
REMARK 500 6 GLU A 66 -166.95 63.65
REMARK 500 6 CYS A 67 108.97 62.45
REMARK 500 6 VAL A 70 -45.75 -152.82
REMARK 500 6 THR A 71 -46.31 -157.00
REMARK 500 7 ALA A 6 50.33 -91.46
REMARK 500 7 THR A 7 85.61 60.95
REMARK 500 7 VAL A 23 -71.87 -89.40
REMARK 500 7 HIS A 26 66.25 -117.99
REMARK 500 7 SER A 60 -70.43 -75.09
REMARK 500 7 SER A 65 103.61 60.29
REMARK 500 7 ARG A 68 -60.11 -139.72
REMARK 500 8 MET A 8 176.47 -58.39
REMARK 500 8 VAL A 23 -68.83 -155.49
REMARK 500 8 HIS A 26 70.30 -114.70
REMARK 500 8 GLU A 66 -47.35 -146.56
REMARK 500 9 VAL A 23 -68.24 -155.26
REMARK 500 9 ASN A 24 -175.58 -177.04
REMARK 500 9 HIS A 26 69.29 -117.78
REMARK 500
REMARK 500 THIS ENTRY HAS 145 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 650
REMARK 650 HELIX
REMARK 650 DETERMINATION METHOD: AUTHOR DETERMINED
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: MMK001004886.1 RELATED DB: TARGETDB
DBREF 1UHS A 9 72 UNP Q8R1H0 HOP_MOUSE 10 73
SEQADV 1UHS GLY A 1 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS SER A 2 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS GLU A 3 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS GLY A 4 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS ALA A 5 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS ALA A 6 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS THR A 7 UNP Q8R1H0 CLONING ARTIFACT
SEQADV 1UHS MET A 8 UNP Q8R1H0 CLONING ARTIFACT
SEQRES 1 A 72 GLY SER GLU GLY ALA ALA THR MET THR GLU ASP GLN VAL
SEQRES 2 A 72 GLU ILE LEU GLU TYR ASN PHE ASN LYS VAL ASN LYS HIS
SEQRES 3 A 72 PRO ASP PRO THR THR LEU CYS LEU ILE ALA ALA GLU ALA
SEQRES 4 A 72 GLY LEU THR GLU GLU GLN THR GLN LYS TRP PHE LYS GLN
SEQRES 5 A 72 ARG LEU ALA GLU TRP ARG ARG SER GLU GLY LEU PRO SER
SEQRES 6 A 72 GLU CYS ARG SER VAL THR ASP
HELIX 1 1 GLU A 10 ASN A 21 1 12
HELIX 2 2 PRO A 29 ALA A 39 1 11
HELIX 3 3 GLU A 43 GLU A 61 1 19
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
(ATOM LINES ARE NOT SHOWN.)
END