Header list of 1hrz.pdb file
Complete list - b 23 2 Bytes
HEADER DNA BINDING PROTEIN/DNA 09-MAY-95 1HRZ
TITLE THE 3D STRUCTURE OF THE HUMAN SRY-DNA COMPLEX SOLVED BY MULTI-
TITLE 2 DIMENSIONAL HETERONUCLEAR-EDITED AND-FILTERED NMR
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: DNA (5'-D(*GP*CP*AP*CP*AP*AP*AP*C)-3');
COMPND 3 CHAIN: B;
COMPND 4 ENGINEERED: YES;
COMPND 5 MOL_ID: 2;
COMPND 6 MOLECULE: DNA (5'-D(*GP*TP*TP*TP*GP*TP*GP*C)-3');
COMPND 7 CHAIN: C;
COMPND 8 ENGINEERED: YES;
COMPND 9 MOL_ID: 3;
COMPND 10 MOLECULE: HUMAN SRY;
COMPND 11 CHAIN: A
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 MOL_ID: 2;
SOURCE 4 SYNTHETIC: YES;
SOURCE 5 MOL_ID: 3;
SOURCE 6 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 7 ORGANISM_COMMON: HUMAN;
SOURCE 8 ORGANISM_TAXID: 9606
KEYWDS DNA BINDING PROTEIN/DNA, DNA BINDING PROTEIN-DNA COMPLEX
EXPDTA SOLUTION NMR
NUMMDL 35
AUTHOR G.M.CLORE,M.H.WERNER,J.R.HUTH,A.M.GRONENBORN
REVDAT 4 23-FEB-22 1HRZ 1 REMARK
REVDAT 3 24-FEB-09 1HRZ 1 VERSN
REVDAT 2 01-APR-03 1HRZ 1 JRNL
REVDAT 1 15-SEP-95 1HRZ 0
JRNL AUTH M.H.WERNER,J.R.HUTH,A.M.GRONENBORN,G.M.CLORE
JRNL TITL MOLECULAR BASIS OF HUMAN 46X,Y SEX REVERSAL REVEALED FROM
JRNL TITL 2 THE THREE-DIMENSIONAL SOLUTION STRUCTURE OF THE HUMAN
JRNL TITL 3 SRY-DNA COMPLEX.
JRNL REF CELL(CAMBRIDGE,MASS.) V. 81 704 1995
JRNL REFN ISSN 0092-8674
JRNL PMID 7774012
JRNL DOI 10.1016/0092-8674(95)90532-4
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : X-PLOR 3.1
REMARK 3 AUTHORS : NULL
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS:
REMARK 3 THE 3D STRUCTURE OF THE HUMAN SRY-DNA COMPLEX SOLVED BY
REMARK 3 MULTI-DIMENSIONAL HETERONUCLEAR-EDITED AND -FILTERED NMR
REMARK 3 IS BASED ON 1805 EXPERIMENTAL RESTRAINTS:
REMARK 3 (A) INTRA-PROTEIN:
REMARK 3 290 SEQUENTIAL (|I-J|=1),
REMARK 3 221 MEDIUM RANGE (1 < |I-J| >=5) AND
REMARK 3 107 LONG RANGE (|I-J| >5) INTERRESIDUES.
REMARK 3 238 INTRARESIDUE APPROXIMATE INTERPROTON DISTANCE
REMARK 3 RESTRAINTS;
REMARK 3 70 DISTANCE RESTRAINTS FOR 35 HYDROGEN BONDS;
REMARK 3 153 TORSION ANGLE (71 PHI, 10 PSI, 56 CHI1 AND 16 CHI2)
REMARK 3 RESTRAINTS;
REMARK 3 56 THREE-BOND HN-HA COUPLING CONSTANT RESTRAINTS;
REMARK 3 145 (73 CALPHA AND 72 CBETA) 13C SHIFT RESTRAINTS.
REMARK 3 (B) INTRA-DNA:
REMARK 3 206 INTRARESIDUE,
REMARK 3 96 SEQUENTIAL INTRASTRAND,
REMARK 3 36 INTERSTRAND INTERPROTON DISTANCE RESTRAINTS;
REMARK 3 40 H-BOND RESTRAINTS;
REMARK 3 72 TORSION ANGLE RESTRAINTS (FOR ALPHA, BETA, GAMMA,
REMARK 3 EPSILON AND ZETA BACKBONE TORSION ANGLES.
REMARK 3 (C) INTERMOLECULAR:
REMARK 3 75 INTERPROTON DISTANCE RESTRAINTS
REMARK 3
REMARK 3 THE STRUCTURES IN THIS ENTRY REPRESENT 35 INDIVIDUAL
REMARK 3 SIMULATED ANNEALING STRUCTURES. THE RESTRAINED REGULARIZED
REMARK 3 MEAN STRUCTURE CAN BE FOUND IN PDB ENTRY 1HRY. THE LAST
REMARK 3 COLUMN IN THE INDIVIDUAL SA STRUCTURES HAS NO MEANING.
REMARK 4
REMARK 4 1HRZ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
REMARK 100 THE DEPOSITION ID IS D_1000173988.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : NULL
REMARK 210 PH : NULL
REMARK 210 IONIC STRENGTH : NULL
REMARK 210 PRESSURE : NULL
REMARK 210 SAMPLE CONTENTS : NULL
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL
REMARK 210 SPECTROMETER FIELD STRENGTH : NULL
REMARK 210 SPECTROMETER MODEL : NULL
REMARK 210 SPECTROMETER MANUFACTURER : NULL
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NULL
REMARK 210 METHOD USED : NULL
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 35
REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL
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: TRIMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, C, 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 MODELS 1-35
REMARK 465 RES C SSSEQI
REMARK 465 VAL A 1
REMARK 465 GLN A 2
REMARK 465 PRO A 76
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
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION
REMARK 500 1 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 3 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 5 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 6 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 8 DT C 10 C5 DT C 10 C7 0.036
REMARK 500 8 DT C 11 C5 DT C 11 C7 0.036
REMARK 500 8 DT C 14 C5 DT C 14 C7 0.038
REMARK 500 10 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 11 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 11 DT C 14 C5 DT C 14 C7 0.039
REMARK 500 12 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 13 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 13 DT C 14 C5 DT C 14 C7 0.039
REMARK 500 14 DT C 14 C5 DT C 14 C7 0.036
REMARK 500 16 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 17 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 18 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 18 DT C 12 C5 DT C 12 C7 0.036
REMARK 500 21 DT C 14 C5 DT C 14 C7 0.038
REMARK 500 22 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 22 DT C 14 C5 DT C 14 C7 0.036
REMARK 500 24 DT C 11 C5 DT C 11 C7 0.038
REMARK 500 24 DT C 14 C5 DT C 14 C7 0.039
REMARK 500 25 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 26 DT C 11 C5 DT C 11 C7 0.037
REMARK 500 26 DT C 14 C5 DT C 14 C7 0.036
REMARK 500 27 DT C 11 C5 DT C 11 C7 0.039
REMARK 500 28 DT C 14 C5 DT C 14 C7 0.036
REMARK 500 30 DT C 11 C5 DT C 11 C7 0.037
REMARK 500 30 DT C 14 C5 DT C 14 C7 0.036
REMARK 500 31 DT C 14 C5 DT C 14 C7 0.038
REMARK 500 32 DT C 14 C5 DT C 14 C7 0.037
REMARK 500 33 DT C 11 C5 DT C 11 C7 0.038
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
REMARK 500 1 DG B 1 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES
REMARK 500 1 DG B 1 C5 - N7 - C8 ANGL. DEV. = -4.0 DEGREES
REMARK 500 1 DG B 1 N7 - C8 - N9 ANGL. DEV. = 7.1 DEGREES
REMARK 500 1 DG B 1 C8 - N9 - C4 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DC B 2 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES
REMARK 500 1 DA B 3 O4' - C1' - N9 ANGL. DEV. = 2.6 DEGREES
REMARK 500 1 DA B 3 C5 - N7 - C8 ANGL. DEV. = -3.8 DEGREES
REMARK 500 1 DA B 3 N7 - C8 - N9 ANGL. DEV. = 6.2 DEGREES
REMARK 500 1 DA B 3 C8 - N9 - C4 ANGL. DEV. = -3.2 DEGREES
REMARK 500 1 DC B 4 O4' - C1' - N1 ANGL. DEV. = 2.3 DEGREES
REMARK 500 1 DA B 5 O4' - C1' - N9 ANGL. DEV. = 4.0 DEGREES
REMARK 500 1 DA B 5 C5 - N7 - C8 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DA B 5 N7 - C8 - N9 ANGL. DEV. = 6.1 DEGREES
REMARK 500 1 DA B 5 C8 - N9 - C4 ANGL. DEV. = -3.3 DEGREES
REMARK 500 1 DA B 6 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES
REMARK 500 1 DA B 6 C5 - N7 - C8 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DA B 6 N7 - C8 - N9 ANGL. DEV. = 6.2 DEGREES
REMARK 500 1 DA B 6 C8 - N9 - C4 ANGL. DEV. = -3.3 DEGREES
REMARK 500 1 DA B 7 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES
REMARK 500 1 DA B 7 C5 - N7 - C8 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DA B 7 N7 - C8 - N9 ANGL. DEV. = 6.2 DEGREES
REMARK 500 1 DA B 7 C8 - N9 - C4 ANGL. DEV. = -3.3 DEGREES
REMARK 500 1 DC B 8 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES
REMARK 500 1 DG C 9 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES
REMARK 500 1 DG C 9 C5 - N7 - C8 ANGL. DEV. = -4.0 DEGREES
REMARK 500 1 DG C 9 N7 - C8 - N9 ANGL. DEV. = 6.9 DEGREES
REMARK 500 1 DG C 9 C8 - N9 - C4 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DT C 10 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES
REMARK 500 1 DT C 11 O4' - C1' - N1 ANGL. DEV. = 1.8 DEGREES
REMARK 500 1 DT C 12 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES
REMARK 500 1 DG C 13 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES
REMARK 500 1 DG C 13 C5 - N7 - C8 ANGL. DEV. = -4.1 DEGREES
REMARK 500 1 DG C 13 N7 - C8 - N9 ANGL. DEV. = 7.0 DEGREES
REMARK 500 1 DG C 13 C8 - N9 - C4 ANGL. DEV. = -3.6 DEGREES
REMARK 500 1 DT C 14 O4' - C1' - N1 ANGL. DEV. = 2.7 DEGREES
REMARK 500 1 DG C 15 O4' - C1' - N9 ANGL. DEV. = 2.9 DEGREES
REMARK 500 1 DG C 15 C5 - N7 - C8 ANGL. DEV. = -4.0 DEGREES
REMARK 500 1 DG C 15 N7 - C8 - N9 ANGL. DEV. = 7.0 DEGREES
REMARK 500 1 DG C 15 C8 - N9 - C4 ANGL. DEV. = -3.7 DEGREES
REMARK 500 1 DC C 16 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES
REMARK 500 2 DG B 1 O4' - C1' - N9 ANGL. DEV. = 2.9 DEGREES
REMARK 500 2 DG B 1 C5 - N7 - C8 ANGL. DEV. = -4.0 DEGREES
REMARK 500 2 DG B 1 N7 - C8 - N9 ANGL. DEV. = 7.1 DEGREES
REMARK 500 2 DG B 1 C8 - N9 - C4 ANGL. DEV. = -3.7 DEGREES
REMARK 500 2 DC B 2 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES
REMARK 500 2 DA B 3 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES
REMARK 500 2 DA B 3 C5 - N7 - C8 ANGL. DEV. = -3.8 DEGREES
REMARK 500 2 DA B 3 N7 - C8 - N9 ANGL. DEV. = 6.1 DEGREES
REMARK 500 2 DA B 3 C8 - N9 - C4 ANGL. DEV. = -3.1 DEGREES
REMARK 500 2 DC B 4 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES
REMARK 500
REMARK 500 THIS ENTRY HAS 1414 ANGLE DEVIATIONS.
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 ARG A 7 77.13 -152.36
REMARK 500 1 ARG A 17 -73.45 -40.41
REMARK 500 1 ARG A 31 -81.27 -76.31
REMARK 500 1 ASN A 32 -169.79 -60.41
REMARK 500 1 SER A 33 73.00 -101.86
REMARK 500 1 ILE A 35 -19.05 -45.82
REMARK 500 1 LYS A 51 -73.68 -64.23
REMARK 500 1 PRO A 53 -73.93 -39.86
REMARK 500 1 PRO A 70 -79.99 -37.95
REMARK 500 2 PRO A 8 -168.37 -67.47
REMARK 500 2 ARG A 17 -73.04 -46.06
REMARK 500 2 PRO A 28 -8.48 -59.25
REMARK 500 2 ARG A 31 -106.62 -76.96
REMARK 500 2 ASN A 32 -145.78 -62.93
REMARK 500 2 SER A 33 71.12 -112.18
REMARK 500 2 ILE A 35 -17.68 -42.98
REMARK 500 2 LYS A 51 -76.67 -70.05
REMARK 500 2 PRO A 53 -72.79 -43.32
REMARK 500 2 PRO A 70 -86.36 -62.94
REMARK 500 2 ASN A 71 -2.79 -53.53
REMARK 500 2 TYR A 74 151.59 -47.30
REMARK 500 3 PRO A 8 -178.66 -58.67
REMARK 500 3 ARG A 17 -70.99 -36.17
REMARK 500 3 ARG A 29 71.05 -104.84
REMARK 500 3 ILE A 35 -18.97 -45.27
REMARK 500 3 LYS A 51 -81.03 -65.47
REMARK 500 3 TYR A 74 153.73 -45.08
REMARK 500 4 ARG A 7 68.84 -152.57
REMARK 500 4 PRO A 8 -165.43 -51.97
REMARK 500 4 ARG A 17 -76.37 -41.08
REMARK 500 4 ASN A 32 -178.60 -176.95
REMARK 500 4 SER A 33 59.72 -90.87
REMARK 500 4 PRO A 53 -73.95 -46.23
REMARK 500 4 PRO A 70 -84.29 -45.59
REMARK 500 4 TYR A 74 179.72 -53.87
REMARK 500 5 PRO A 8 -178.43 -61.94
REMARK 500 5 ALA A 11 -17.82 -48.70
REMARK 500 5 ARG A 17 -78.05 -38.92
REMARK 500 5 ASN A 32 -170.09 53.76
REMARK 500 5 ILE A 35 -16.55 -45.51
REMARK 500 5 LYS A 51 -78.62 -69.42
REMARK 500 5 PRO A 53 -74.17 -41.79
REMARK 500 5 LEU A 61 -72.81 -49.44
REMARK 500 6 PRO A 8 -169.95 -73.56
REMARK 500 6 LEU A 25 -74.64 -67.01
REMARK 500 6 PRO A 28 7.90 -63.86
REMARK 500 6 ARG A 31 -91.56 -75.16
REMARK 500 6 ASN A 32 -171.97 -68.68
REMARK 500 6 ILE A 35 -18.22 -45.92
REMARK 500 6 LYS A 51 -77.19 -66.83
REMARK 500
REMARK 500 THIS ENTRY HAS 291 RAMACHANDRAN OUTLIERS.
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 8 ARG A 7 0.14 SIDE CHAIN
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 1HRY RELATED DB: PDB
DBREF 1HRZ A 1 76 UNP Q05066 SRY_HUMAN 56 131
DBREF 1HRZ B 1 8 PDB 1HRZ 1HRZ 1 8
DBREF 1HRZ C 9 16 PDB 1HRZ 1HRZ 9 16
SEQRES 1 B 8 DG DC DA DC DA DA DA DC
SEQRES 1 C 8 DG DT DT DT DG DT DG DC
SEQRES 1 A 76 VAL GLN ASP ARG VAL LYS ARG PRO MET ASN ALA PHE ILE
SEQRES 2 A 76 VAL TRP SER ARG ASP GLN ARG ARG LYS MET ALA LEU GLU
SEQRES 3 A 76 ASN PRO ARG MET ARG ASN SER GLU ILE SER LYS GLN LEU
SEQRES 4 A 76 GLY TYR GLN TRP LYS MET LEU THR GLU ALA GLU LYS TRP
SEQRES 5 A 76 PRO PHE PHE GLN GLU ALA GLN LYS LEU GLN ALA MET HIS
SEQRES 6 A 76 ARG GLU LYS TYR PRO ASN TYR LYS TYR ARG PRO
HELIX 1 1 ALA A 11 GLU A 26 1 16
HELIX 2 2 GLU A 34 MET A 45 1 12
HELIX 3 3 GLU A 48 LYS A 68 1 21
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 - b 23 2 Bytes