Header list of 2err.pdb file
Complete list - r 9 2 Bytes
HEADER RNA BINDING PROTEIN 25-OCT-05 2ERR
TITLE NMR STRUCTURE OF THE RNA BINDING DOMAIN OF HUMAN FOX-1 IN COMPLEX WITH
TITLE 2 UGCAUGU
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: UGCAUGU;
COMPND 3 CHAIN: B;
COMPND 4 ENGINEERED: YES;
COMPND 5 MOL_ID: 2;
COMPND 6 MOLECULE: ATAXIN-2-BINDING PROTEIN 1;
COMPND 7 CHAIN: A;
COMPND 8 FRAGMENT: RNA BINDING DOMAIN;
COMPND 9 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS.;
SOURCE 4 MOL_ID: 2;
SOURCE 5 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 6 ORGANISM_COMMON: HUMAN;
SOURCE 7 ORGANISM_TAXID: 9606;
SOURCE 8 GENE: A2BP1, A2BP;
SOURCE 9 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);
SOURCE 10 EXPRESSION_SYSTEM_TAXID: 469008;
SOURCE 11 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
SOURCE 12 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 13 EXPRESSION_SYSTEM_PLASMID: PET28A+
KEYWDS PROTEIN-RNA COMPLEX, RNA BINDING PROTEIN
EXPDTA SOLUTION NMR
NUMMDL 30
AUTHOR F.H.ALLAIN,S.D.AUWETER
REVDAT 4 09-MAR-22 2ERR 1 REMARK SEQADV
REVDAT 3 24-FEB-09 2ERR 1 VERSN
REVDAT 2 17-JAN-06 2ERR 1 JRNL
REVDAT 1 10-JAN-06 2ERR 0
JRNL AUTH S.D.AUWETER,R.FASAN,L.REYMOND,J.G.UNDERWOOD,D.L.BLACK,
JRNL AUTH 2 S.PITSCH,F.H.ALLAIN
JRNL TITL MOLECULAR BASIS OF RNA RECOGNITION BY THE HUMAN ALTERNATIVE
JRNL TITL 2 SPLICING FACTOR FOX-1.
JRNL REF EMBO J. V. 25 163 2006
JRNL REFN ISSN 0261-4189
JRNL PMID 16362037
JRNL DOI 10.1038/SJ.EMBOJ.7600918
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : CYANA 2.0, AMBER 7.0
REMARK 3 AUTHORS : PETER GUENTERT (CYANA), DAVID A. CASE (AMBER)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL OF
REMARK 3 1460 NOE-DERIVED DISTANCE CONSTRAINTS, 29 HYDROGEN BOND
REMARK 3 CONSTRAINTS AND 6 TORSION ANGLE CONSTRAINTS. 149 AND 119 OF THE
REMARK 3 NOE CONSTRAINTS ARE INTERMOLECULAR AND INTRA-RNA, RESPECTIVELY.
REMARK 4
REMARK 4 2ERR COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 31-OCT-05.
REMARK 100 THE DEPOSITION ID IS D_1000035013.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 313
REMARK 210 PH : 6.5
REMARK 210 IONIC STRENGTH : NULL
REMARK 210 PRESSURE : 1 ATM
REMARK 210 SAMPLE CONTENTS : 1MM FOX-1 15N; 1MM UGCAUGU; 20MM
REMARK 210 SODIUM PHOSHPHATE; 30MM NACL;
REMARK 210 1MM FOX-1 15N, 13C; 1MM UGUAUGU;
REMARK 210 20MM SODIUM PHOSHPHATE; 30MM
REMARK 210 NACL; 1MM FOX-1 15N; 1MM UGCAUGU;
REMARK 210 20MM SODIUM PHOSHPHATE; 30MM
REMARK 210 NACL; 1MM FOX-1 15N, 13C; 1MM
REMARK 210 UGCAUGU; 20MM SODIUM PHOSHPHATE;
REMARK 210 30MM NACL; 1MM FOX-1 15N; 1MM
REMARK 210 UGCAUGU, SUGARS OF U1, C3, U5
REMARK 210 13C; 20MM SODIUM PHOSHPHATE;
REMARK 210 30MM NACL; 1MM FOX-1 15N; 1MM
REMARK 210 UGCAUGU, SUGARS OF G2, A4, G6,
REMARK 210 U7 13C; 20MM SODIUM PHOSHPHATE;
REMARK 210 30MM NACL
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 3D_13C
REMARK 210 -SEPARATED_NOESY; 3D_15N-
REMARK 210 SEPARATED_NOESY; HNCA; CBCACONH;
REMARK 210 HNCOCA; HCCH-TOCSY; 2D F1,F2-
REMARK 210 EDITED NOESY; 2D F1-EDITED, F2-
REMARK 210 FITERED NOESY
REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 600 MHZ; 900 MHZ
REMARK 210 SPECTROMETER MODEL : DRX; AVANCE
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NULL
REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 30
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 30
REMARK 210 CONFORMERS, SELECTION CRITERIA : ALL CALCULATED STRUCTURES
REMARK 210 SUBMITTED
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: DIMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, 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 1-30
REMARK 465 RES C SSSEQI
REMARK 465 MET A 88
REMARK 465 GLY A 89
REMARK 465 SER A 90
REMARK 465 SER A 91
REMARK 465 HIS A 92
REMARK 465 HIS A 93
REMARK 465 HIS A 94
REMARK 465 HIS A 95
REMARK 465 HIS A 96
REMARK 465 HIS A 97
REMARK 465 SER A 98
REMARK 465 SER A 99
REMARK 465 GLY A 100
REMARK 465 LEU A 101
REMARK 465 VAL A 102
REMARK 465 PRO A 103
REMARK 465 ARG A 104
REMARK 465 GLY A 105
REMARK 465 SER A 106
REMARK 465 HIS A 107
REMARK 465 MET A 108
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 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 1 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.8 DEGREES
REMARK 500 1 G B 202 O4' - C1' - N9 ANGL. DEV. = 6.0 DEGREES
REMARK 500 1 U B 203 O4' - C1' - N1 ANGL. DEV. = 5.0 DEGREES
REMARK 500 1 ARG A 173 NE - CZ - NH1 ANGL. DEV. = 4.8 DEGREES
REMARK 500 1 ARG A 184 NE - CZ - NH1 ANGL. DEV. = 3.4 DEGREES
REMARK 500 2 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 2 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 2 G B 202 O4' - C1' - N9 ANGL. DEV. = 6.2 DEGREES
REMARK 500 2 G B 202 N1 - C6 - O6 ANGL. DEV. = -3.9 DEGREES
REMARK 500 2 U B 203 O4' - C1' - N1 ANGL. DEV. = 5.2 DEGREES
REMARK 500 3 U B 197 N3 - C2 - O2 ANGL. DEV. = -4.2 DEGREES
REMARK 500 3 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.3 DEGREES
REMARK 500 3 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 3 G B 202 O4' - C1' - N9 ANGL. DEV. = 5.1 DEGREES
REMARK 500 3 ARG A 118 NE - CZ - NH1 ANGL. DEV. = 4.2 DEGREES
REMARK 500 3 ARG A 171 NE - CZ - NH1 ANGL. DEV. = 3.5 DEGREES
REMARK 500 3 ARG A 194 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 4 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.4 DEGREES
REMARK 500 4 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.9 DEGREES
REMARK 500 4 G B 202 O4' - C1' - N9 ANGL. DEV. = 5.6 DEGREES
REMARK 500 4 U B 203 C5' - C4' - C3' ANGL. DEV. = 10.1 DEGREES
REMARK 500 4 U B 203 O4' - C1' - N1 ANGL. DEV. = 4.3 DEGREES
REMARK 500 4 ARG A 127 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES
REMARK 500 5 U B 197 N3 - C2 - O2 ANGL. DEV. = -4.7 DEGREES
REMARK 500 5 C B 199 O4' - C1' - N1 ANGL. DEV. = 4.4 DEGREES
REMARK 500 5 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 5 A B 200 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES
REMARK 500 5 A B 200 C5 - C6 - N1 ANGL. DEV. = 4.0 DEGREES
REMARK 500 5 A B 200 N1 - C6 - N6 ANGL. DEV. = -5.0 DEGREES
REMARK 500 5 G B 202 N3 - C2 - N2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 5 ARG A 118 NE - CZ - NH1 ANGL. DEV. = 4.1 DEGREES
REMARK 500 5 ARG A 173 NE - CZ - NH1 ANGL. DEV. = 4.0 DEGREES
REMARK 500 5 ARG A 173 NE - CZ - NH2 ANGL. DEV. = -3.6 DEGREES
REMARK 500 5 VAL A 188 CA - CB - CG2 ANGL. DEV. = 9.2 DEGREES
REMARK 500 6 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 6 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 6 U B 203 O4' - C1' - N1 ANGL. DEV. = 5.9 DEGREES
REMARK 500 7 G B 198 O4' - C1' - N9 ANGL. DEV. = 4.4 DEGREES
REMARK 500 7 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.3 DEGREES
REMARK 500 7 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 7 A B 200 C3' - O3' - P ANGL. DEV. = 8.0 DEGREES
REMARK 500 7 G B 202 O4' - C1' - N9 ANGL. DEV. = 4.4 DEGREES
REMARK 500 7 U B 203 C5' - C4' - C3' ANGL. DEV. = 9.9 DEGREES
REMARK 500 7 U B 203 O4' - C1' - N1 ANGL. DEV. = 5.2 DEGREES
REMARK 500 7 ARG A 134 NE - CZ - NH1 ANGL. DEV. = 3.6 DEGREES
REMARK 500 7 ARG A 173 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES
REMARK 500 8 C B 199 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES
REMARK 500 8 A B 200 C5 - C6 - N1 ANGL. DEV. = 3.9 DEGREES
REMARK 500 8 G B 202 O4' - C1' - N9 ANGL. DEV. = 5.3 DEGREES
REMARK 500
REMARK 500 THIS ENTRY HAS 201 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 LYS A 117 -179.84 -173.88
REMARK 500 1 ASN A 123 18.35 59.46
REMARK 500 1 PHE A 126 -6.69 -57.31
REMARK 500 1 GLU A 147 65.83 -161.77
REMARK 500 1 PHE A 150 140.30 33.30
REMARK 500 1 SER A 155 1.51 -59.36
REMARK 500 1 LYS A 156 -9.24 56.30
REMARK 500 1 PHE A 163 -34.32 -154.53
REMARK 500 1 ASN A 165 -52.34 -146.77
REMARK 500 1 ALA A 193 80.52 -156.59
REMARK 500 2 LYS A 117 135.99 170.45
REMARK 500 2 GLU A 147 87.86 -165.28
REMARK 500 2 PHE A 163 -34.93 -142.87
REMARK 500 2 ASN A 165 -47.71 -150.21
REMARK 500 2 GLU A 182 -72.58 55.33
REMARK 500 3 PRO A 125 16.04 -58.64
REMARK 500 3 PHE A 126 -48.09 61.47
REMARK 500 3 GLU A 147 87.09 -165.82
REMARK 500 3 PHE A 163 -51.67 -155.23
REMARK 500 3 VAL A 181 -76.63 -92.26
REMARK 500 3 GLU A 182 32.43 -90.79
REMARK 500 4 GLU A 147 72.38 -164.55
REMARK 500 4 PHE A 163 -45.05 -154.43
REMARK 500 4 ASN A 165 -63.97 -145.59
REMARK 500 4 VAL A 195 175.52 51.75
REMARK 500 5 LYS A 113 -40.07 56.67
REMARK 500 5 PHE A 163 -68.01 -152.24
REMARK 500 5 ALA A 193 74.11 -151.59
REMARK 500 6 THR A 110 -85.72 22.34
REMARK 500 6 LYS A 117 65.36 -169.48
REMARK 500 6 ARG A 118 151.52 77.46
REMARK 500 6 PHE A 163 -41.36 -146.31
REMARK 500 6 ASN A 165 -36.51 -151.58
REMARK 500 6 GLU A 182 19.15 52.00
REMARK 500 7 PRO A 116 174.62 -55.61
REMARK 500 7 GLU A 147 82.50 -166.00
REMARK 500 7 PHE A 163 -45.18 -157.18
REMARK 500 7 GLU A 182 -79.82 -132.91
REMARK 500 7 ALA A 193 77.76 -153.36
REMARK 500 8 PRO A 116 -176.17 -58.85
REMARK 500 8 LYS A 117 94.00 97.80
REMARK 500 8 ASN A 123 19.84 59.22
REMARK 500 8 ILE A 149 59.08 -96.01
REMARK 500 8 SER A 155 10.59 -65.24
REMARK 500 8 LYS A 156 6.66 54.21
REMARK 500 8 PHE A 163 -28.17 -149.29
REMARK 500 8 ASN A 165 -14.03 -141.30
REMARK 500 9 ASN A 112 81.71 14.15
REMARK 500 9 LYS A 117 121.92 119.55
REMARK 500 9 PHE A 128 160.28 -49.41
REMARK 500
REMARK 500 THIS ENTRY HAS 198 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS
REMARK 500
REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH
REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED
REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND
REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES.
REMARK 500 MODEL OMEGA
REMARK 500 LYS A 117 ARG A 118 1 -143.91
REMARK 500 ARG A 118 LEU A 119 1 -143.85
REMARK 500 THR A 162 PHE A 163 1 -143.74
REMARK 500 GLU A 164 ASN A 165 1 142.80
REMARK 500 ALA A 191 THR A 192 1 149.08
REMARK 500 ARG A 118 LEU A 119 2 -149.69
REMARK 500 THR A 162 PHE A 163 2 -136.31
REMARK 500 PHE A 163 GLU A 164 2 -145.13
REMARK 500 GLU A 164 ASN A 165 2 147.67
REMARK 500 ALA A 193 ARG A 194 2 -149.17
REMARK 500 LYS A 117 ARG A 118 3 -128.80
REMARK 500 ARG A 118 LEU A 119 3 -142.49
REMARK 500 THR A 162 PHE A 163 3 -142.65
REMARK 500 PHE A 163 GLU A 164 3 -134.24
REMARK 500 GLU A 164 ASN A 165 3 -144.74
REMARK 500 ALA A 193 ARG A 194 3 -148.41
REMARK 500 LYS A 117 ARG A 118 4 -130.95
REMARK 500 ARG A 118 LEU A 119 4 -139.32
REMARK 500 THR A 162 PHE A 163 4 -139.42
REMARK 500 GLU A 164 ASN A 165 4 147.10
REMARK 500 ALA A 191 THR A 192 4 148.28
REMARK 500 LYS A 117 ARG A 118 5 -132.96
REMARK 500 ARG A 118 LEU A 119 5 -143.39
REMARK 500 THR A 162 PHE A 163 5 -144.84
REMARK 500 PHE A 163 GLU A 164 5 -136.49
REMARK 500 LYS A 117 ARG A 118 6 144.54
REMARK 500 ARG A 118 LEU A 119 6 -144.59
REMARK 500 THR A 162 PHE A 163 6 -144.72
REMARK 500 GLU A 164 ASN A 165 6 136.24
REMARK 500 LYS A 117 ARG A 118 7 -133.08
REMARK 500 ARG A 118 LEU A 119 7 -140.49
REMARK 500 THR A 162 PHE A 163 7 -140.83
REMARK 500 PHE A 163 GLU A 164 7 -132.66
REMARK 500 GLU A 164 ASN A 165 7 -142.23
REMARK 500 THR A 162 PHE A 163 8 -144.23
REMARK 500 PHE A 163 GLU A 164 8 -142.54
REMARK 500 PHE A 163 GLU A 164 9 149.75
REMARK 500 THR A 162 PHE A 163 10 -146.30
REMARK 500 GLU A 164 ASN A 165 10 136.04
REMARK 500 LYS A 117 ARG A 118 11 -134.84
REMARK 500 ARG A 118 LEU A 119 11 -141.20
REMARK 500 THR A 162 PHE A 163 11 -143.22
REMARK 500 GLU A 164 ASN A 165 11 138.22
REMARK 500 ALA A 191 THR A 192 11 146.57
REMARK 500 LYS A 117 ARG A 118 12 -124.99
REMARK 500 ARG A 118 LEU A 119 12 -139.15
REMARK 500 THR A 162 PHE A 163 12 -142.37
REMARK 500 PHE A 163 GLU A 164 12 -139.11
REMARK 500 GLU A 164 ASN A 165 12 -147.99
REMARK 500 THR A 192 ALA A 193 12 141.06
REMARK 500
REMARK 500 THIS ENTRY HAS 121 NON CIS, NON-TRANS OMEGA 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 1 U B 197 0.17 SIDE CHAIN
REMARK 500 1 U B 203 0.06 SIDE CHAIN
REMARK 500 2 U B 197 0.13 SIDE CHAIN
REMARK 500 4 U B 197 0.12 SIDE CHAIN
REMARK 500 5 U B 197 0.09 SIDE CHAIN
REMARK 500 5 C B 199 0.09 SIDE CHAIN
REMARK 500 5 A B 200 0.09 SIDE CHAIN
REMARK 500 6 U B 197 0.14 SIDE CHAIN
REMARK 500 6 U B 201 0.06 SIDE CHAIN
REMARK 500 6 U B 203 0.06 SIDE CHAIN
REMARK 500 7 U B 197 0.15 SIDE CHAIN
REMARK 500 8 U B 197 0.21 SIDE CHAIN
REMARK 500 10 U B 201 0.06 SIDE CHAIN
REMARK 500 10 U B 203 0.06 SIDE CHAIN
REMARK 500 11 U B 197 0.13 SIDE CHAIN
REMARK 500 11 U B 203 0.06 SIDE CHAIN
REMARK 500 12 C B 199 0.07 SIDE CHAIN
REMARK 500 13 U B 201 0.06 SIDE CHAIN
REMARK 500 13 U B 203 0.06 SIDE CHAIN
REMARK 500 14 U B 197 0.17 SIDE CHAIN
REMARK 500 14 U B 201 0.09 SIDE CHAIN
REMARK 500 14 U B 203 0.06 SIDE CHAIN
REMARK 500 15 U B 197 0.13 SIDE CHAIN
REMARK 500 15 HIS A 177 0.08 SIDE CHAIN
REMARK 500 16 C B 199 0.07 SIDE CHAIN
REMARK 500 16 U B 201 0.09 SIDE CHAIN
REMARK 500 16 G B 202 0.06 SIDE CHAIN
REMARK 500 16 U B 203 0.07 SIDE CHAIN
REMARK 500 17 U B 197 0.12 SIDE CHAIN
REMARK 500 18 U B 203 0.06 SIDE CHAIN
REMARK 500 19 C B 199 0.07 SIDE CHAIN
REMARK 500 19 U B 203 0.07 SIDE CHAIN
REMARK 500 20 G B 198 0.07 SIDE CHAIN
REMARK 500 20 C B 199 0.07 SIDE CHAIN
REMARK 500 20 A B 200 0.10 SIDE CHAIN
REMARK 500 21 U B 203 0.06 SIDE CHAIN
REMARK 500 22 U B 197 0.13 SIDE CHAIN
REMARK 500 23 G B 198 0.08 SIDE CHAIN
REMARK 500 23 U B 203 0.06 SIDE CHAIN
REMARK 500 24 U B 197 0.14 SIDE CHAIN
REMARK 500 24 U B 201 0.06 SIDE CHAIN
REMARK 500 24 U B 203 0.06 SIDE CHAIN
REMARK 500 25 G B 198 0.06 SIDE CHAIN
REMARK 500 25 C B 199 0.07 SIDE CHAIN
REMARK 500 26 G B 198 0.07 SIDE CHAIN
REMARK 500 26 U B 203 0.06 SIDE CHAIN
REMARK 500 26 PHE A 150 0.09 SIDE CHAIN
REMARK 500 27 U B 197 0.13 SIDE CHAIN
REMARK 500 27 U B 203 0.07 SIDE CHAIN
REMARK 500 27 HIS A 177 0.11 SIDE CHAIN
REMARK 500
REMARK 500 THIS ENTRY HAS 58 PLANE DEVIATIONS.
REMARK 500
REMARK 500 REMARK: NULL
DBREF 2ERR A 109 196 UNP Q9NWB1 A2BP1_HUMAN 109 196
DBREF 2ERR B 197 203 PDB 2ERR 2ERR 197 203
SEQADV 2ERR MET A 88 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR GLY A 89 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR SER A 90 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR SER A 91 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 92 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 93 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 94 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 95 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 96 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 97 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR SER A 98 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR SER A 99 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR GLY A 100 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR LEU A 101 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR VAL A 102 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR PRO A 103 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR ARG A 104 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR GLY A 105 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR SER A 106 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR HIS A 107 UNP Q9NWB1 EXPRESSION TAG
SEQADV 2ERR MET A 108 UNP Q9NWB1 EXPRESSION TAG
SEQRES 1 B 7 U G C A U G U
SEQRES 1 A 109 MET GLY SER SER HIS HIS HIS HIS HIS HIS SER SER GLY
SEQRES 2 A 109 LEU VAL PRO ARG GLY SER HIS MET ASN THR GLU ASN LYS
SEQRES 3 A 109 SER GLN PRO LYS ARG LEU HIS VAL SER ASN ILE PRO PHE
SEQRES 4 A 109 ARG PHE ARG ASP PRO ASP LEU ARG GLN MET PHE GLY GLN
SEQRES 5 A 109 PHE GLY LYS ILE LEU ASP VAL GLU ILE ILE PHE ASN GLU
SEQRES 6 A 109 ARG GLY SER LYS GLY PHE GLY PHE VAL THR PHE GLU ASN
SEQRES 7 A 109 SER ALA ASP ALA ASP ARG ALA ARG GLU LYS LEU HIS GLY
SEQRES 8 A 109 THR VAL VAL GLU GLY ARG LYS ILE GLU VAL ASN ASN ALA
SEQRES 9 A 109 THR ALA ARG VAL MET
HELIX 1 1 ARG A 129 PHE A 137 1 9
HELIX 2 2 GLY A 138 PHE A 140 5 3
HELIX 3 3 SER A 166 HIS A 177 1 12
SHEET 1 A 4 VAL A 146 ILE A 148 0
SHEET 2 A 4 PHE A 158 THR A 162 -1 O PHE A 160 N GLU A 147
SHEET 3 A 4 ARG A 118 SER A 122 -1 N VAL A 121 O GLY A 159
SHEET 4 A 4 GLU A 187 ASN A 190 -1 O GLU A 187 N SER A 122
SHEET 1 B 2 VAL A 180 VAL A 181 0
SHEET 2 B 2 ARG A 184 LYS A 185 -1 O ARG A 184 N VAL A 181
CISPEP 1 ALA A 193 ARG A 194 1 -10.39
CISPEP 2 LYS A 117 ARG A 118 2 -24.77
CISPEP 3 ALA A 193 ARG A 194 5 -8.88
CISPEP 4 ALA A 193 ARG A 194 6 -12.46
CISPEP 5 ALA A 193 ARG A 194 7 -3.47
CISPEP 6 LYS A 117 ARG A 118 8 -10.58
CISPEP 7 ALA A 193 ARG A 194 8 -11.99
CISPEP 8 LYS A 117 ARG A 118 9 -13.26
CISPEP 9 ALA A 193 ARG A 194 9 -14.60
CISPEP 10 ALA A 193 ARG A 194 10 -4.71
CISPEP 11 ALA A 193 ARG A 194 12 -5.59
CISPEP 12 ALA A 193 ARG A 194 13 -6.70
CISPEP 13 LYS A 117 ARG A 118 15 -20.59
CISPEP 14 ALA A 193 ARG A 194 15 -5.69
CISPEP 15 ALA A 193 ARG A 194 17 -10.95
CISPEP 16 ALA A 193 ARG A 194 18 -3.06
CISPEP 17 ALA A 193 ARG A 194 19 -4.03
CISPEP 18 ALA A 193 ARG A 194 20 -12.86
CISPEP 19 GLN A 115 PRO A 116 21 -18.89
CISPEP 20 ALA A 193 ARG A 194 21 -14.18
CISPEP 21 VAL A 195 MET A 196 21 -12.34
CISPEP 22 LYS A 117 ARG A 118 24 -15.33
CISPEP 23 ALA A 193 ARG A 194 24 -9.54
CISPEP 24 VAL A 195 MET A 196 24 -11.02
CISPEP 25 LYS A 117 ARG A 118 25 -15.62
CISPEP 26 LYS A 117 ARG A 118 26 -17.25
CISPEP 27 ALA A 193 ARG A 194 26 -1.10
CISPEP 28 ALA A 193 ARG A 194 27 -13.76
CISPEP 29 ALA A 193 ARG A 194 28 -15.85
CISPEP 30 GLN A 115 PRO A 116 29 -9.64
CISPEP 31 LYS A 117 ARG A 118 30 -8.37
CISPEP 32 ALA A 193 ARG A 194 30 -14.45
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