Header list of 1iva.pdb file
Complete list - 23 20 Bytes
HEADER NEUROTOXIN 27-OCT-94 1IVA
TITLE STRUCTURE-ACTIVITY RELATIONSHIPS FOR P-TYPE CALCIUM CHANNEL SELECTIVE
TITLE 2 OMEGA-AGATOXINS
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: OMEGA-AGATOXIN-IVA;
COMPND 3 CHAIN: A;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: AGELENOPSIS APERTA;
SOURCE 3 ORGANISM_TAXID: 6908
KEYWDS NEUROTOXIN
EXPDTA SOLUTION NMR
NUMMDL 16
AUTHOR M.D.REILY,K.E.HOLUB
REVDAT 3 23-FEB-22 1IVA 1 REMARK
REVDAT 2 24-FEB-09 1IVA 1 VERSN
REVDAT 1 07-FEB-95 1IVA 0
JRNL AUTH M.D.REILY,K.E.HOLUB,W.R.GRAY,T.M.NORRIS,M.E.ADAMS
JRNL TITL STRUCTURE-ACTIVITY RELATIONSHIPS FOR P-TYPE CALCIUM
JRNL TITL 2 CHANNEL-SELECTIVE OMEGA-AGATOXINS.
JRNL REF NAT.STRUCT.BIOL. V. 1 853 1994
JRNL REFN ISSN 1072-8368
JRNL PMID 7773772
JRNL DOI 10.1038/NSB1294-853
REMARK 1
REMARK 1 REFERENCE 1
REMARK 1 AUTH M.D.REILY,V.THANABAL,M.E.ADAMS
REMARK 1 TITL THE SOLUTION STRUCTURE OF OMEGA-AGA-IVB, A P-TYPE CALCIUM
REMARK 1 TITL 2 CHANNEL ANTAGONIST FROM VENOM OF AGELENOPSIS APERTA
REMARK 1 REF TO BE PUBLISHED
REMARK 1 REFN
REMARK 1 REFERENCE 2
REMARK 1 AUTH I.M.MINTZ,V.J.VENEMA,K.M.SWIDEREK,T.D.LEE,B.P.BEAN,M.E.ADAMS
REMARK 1 TITL P-TYPE CALCIUM CHANNELS BLOCKED BY THE SPIDER TOXIN
REMARK 1 TITL 2 OMEGA-AGA-IVA
REMARK 1 REF NATURE V. 355 827 1992
REMARK 1 REFN ISSN 0028-0836
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : DISCOVER
REMARK 3 AUTHORS : BIOSYM TECHNOLOGIES
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1IVA 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_1000174273.
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 : 16
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: 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
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 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 1 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 1 ALA A 48 C ALA A 48 OXT 0.144
REMARK 500 2 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 2 GLU A 43 CD GLU A 43 OE2 0.121
REMARK 500 2 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 3 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 3 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 3 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 4 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 4 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 4 ALA A 48 C ALA A 48 OXT 0.144
REMARK 500 5 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 5 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 5 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 6 GLU A 35 CD GLU A 35 OE2 0.119
REMARK 500 6 GLU A 43 CD GLU A 43 OE2 0.119
REMARK 500 6 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 7 GLU A 35 CD GLU A 35 OE2 0.121
REMARK 500 7 GLU A 43 CD GLU A 43 OE2 0.119
REMARK 500 7 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 8 GLU A 35 CD GLU A 35 OE2 0.118
REMARK 500 8 GLU A 43 CD GLU A 43 OE2 0.119
REMARK 500 8 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 9 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 9 GLU A 43 CD GLU A 43 OE2 0.118
REMARK 500 9 ALA A 48 C ALA A 48 OXT 0.144
REMARK 500 10 GLU A 35 CD GLU A 35 OE2 0.119
REMARK 500 10 GLU A 43 CD GLU A 43 OE2 0.119
REMARK 500 10 ALA A 48 C ALA A 48 OXT 0.143
REMARK 500 11 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 11 GLU A 43 CD GLU A 43 OE2 0.118
REMARK 500 11 ALA A 48 C ALA A 48 OXT 0.146
REMARK 500 12 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 12 GLU A 43 CD GLU A 43 OE2 0.121
REMARK 500 12 ALA A 48 C ALA A 48 OXT 0.146
REMARK 500 13 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 13 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 13 ALA A 48 C ALA A 48 OXT 0.142
REMARK 500 14 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 14 GLU A 43 CD GLU A 43 OE2 0.117
REMARK 500 14 ALA A 48 C ALA A 48 OXT 0.147
REMARK 500 15 GLU A 35 CD GLU A 35 OE2 0.121
REMARK 500 15 GLU A 43 CD GLU A 43 OE2 0.119
REMARK 500 15 ALA A 48 C ALA A 48 OXT 0.146
REMARK 500 16 GLU A 35 CD GLU A 35 OE2 0.120
REMARK 500 16 GLU A 43 CD GLU A 43 OE2 0.120
REMARK 500 16 ALA A 48 C ALA A 48 OXT 0.144
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 ASP A 8 CB - CG - OD2 ANGL. DEV. = -6.1 DEGREES
REMARK 500 1 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 1 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 3.8 DEGREES
REMARK 500 1 ASN A 33 N - CA - CB ANGL. DEV. = -12.3 DEGREES
REMARK 500 1 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 1 GLU A 43 CB - CA - C ANGL. DEV. = 18.4 DEGREES
REMARK 500 2 ASP A 8 CB - CG - OD2 ANGL. DEV. = -6.0 DEGREES
REMARK 500 2 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.6 DEGREES
REMARK 500 2 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 2 CYS A 25 CA - CB - SG ANGL. DEV. = -12.7 DEGREES
REMARK 500 2 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.8 DEGREES
REMARK 500 2 GLU A 43 CB - CA - C ANGL. DEV. = 16.1 DEGREES
REMARK 500 2 GLU A 43 N - CA - CB ANGL. DEV. = -15.8 DEGREES
REMARK 500 3 ASP A 8 CB - CG - OD2 ANGL. DEV. = -5.9 DEGREES
REMARK 500 3 ARG A 11 CD - NE - CZ ANGL. DEV. = 8.5 DEGREES
REMARK 500 3 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.6 DEGREES
REMARK 500 3 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 3.5 DEGREES
REMARK 500 3 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 4 CYS A 4 N - CA - CB ANGL. DEV. = -12.2 DEGREES
REMARK 500 4 ASP A 8 CB - CG - OD2 ANGL. DEV. = -5.8 DEGREES
REMARK 500 4 ARG A 11 CD - NE - CZ ANGL. DEV. = 8.6 DEGREES
REMARK 500 4 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 4 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 4.0 DEGREES
REMARK 500 4 CYS A 25 N - CA - CB ANGL. DEV. = 10.3 DEGREES
REMARK 500 4 THR A 32 N - CA - CB ANGL. DEV. = 15.2 DEGREES
REMARK 500 4 ASN A 33 N - CA - CB ANGL. DEV. = -13.8 DEGREES
REMARK 500 4 ASN A 33 N - CA - C ANGL. DEV. = 23.5 DEGREES
REMARK 500 4 CYS A 34 CA - CB - SG ANGL. DEV. = 6.6 DEGREES
REMARK 500 4 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.9 DEGREES
REMARK 500 5 ASP A 8 CB - CG - OD2 ANGL. DEV. = -5.6 DEGREES
REMARK 500 5 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 5 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 4.0 DEGREES
REMARK 500 5 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 5 GLU A 43 CB - CA - C ANGL. DEV. = 16.1 DEGREES
REMARK 500 6 CYS A 4 N - CA - CB ANGL. DEV. = -12.1 DEGREES
REMARK 500 6 ASP A 8 CB - CG - OD2 ANGL. DEV. = -5.8 DEGREES
REMARK 500 6 ARG A 11 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES
REMARK 500 6 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 6 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 6 CYS A 25 CA - CB - SG ANGL. DEV. = -11.0 DEGREES
REMARK 500 6 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.9 DEGREES
REMARK 500 7 ASP A 8 CB - CG - OD1 ANGL. DEV. = 5.5 DEGREES
REMARK 500 7 ASP A 8 CB - CG - OD2 ANGL. DEV. = -6.2 DEGREES
REMARK 500 7 ARG A 21 NE - CZ - NH1 ANGL. DEV. = 3.6 DEGREES
REMARK 500 7 ARG A 23 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 7 SER A 28 N - CA - CB ANGL. DEV. = -10.5 DEGREES
REMARK 500 7 ASN A 33 N - CA - CB ANGL. DEV. = -12.3 DEGREES
REMARK 500 7 ARG A 39 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES
REMARK 500 8 CYS A 4 N - CA - CB ANGL. DEV. = -11.1 DEGREES
REMARK 500 8 CYS A 4 N - CA - C ANGL. DEV. = 16.2 DEGREES
REMARK 500
REMARK 500 THIS ENTRY HAS 128 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 2 86.95 54.34
REMARK 500 1 LYS A 3 89.26 66.20
REMARK 500 1 CYS A 4 167.94 52.41
REMARK 500 1 ALA A 6 61.60 72.19
REMARK 500 1 LYS A 7 131.71 -179.50
REMARK 500 1 TYR A 9 39.83 72.58
REMARK 500 1 PRO A 18 -127.86 -66.69
REMARK 500 1 CYS A 20 -64.45 -93.35
REMARK 500 1 SER A 28 -150.43 -79.40
REMARK 500 1 ILE A 29 56.87 -98.65
REMARK 500 1 MET A 30 -40.38 -168.64
REMARK 500 1 THR A 32 -72.17 -157.93
REMARK 500 1 ASN A 33 39.43 -70.31
REMARK 500 1 CYS A 34 -157.40 -68.28
REMARK 500 1 LYS A 37 153.70 -47.49
REMARK 500 1 ARG A 39 109.77 -163.02
REMARK 500 1 LEU A 40 -67.72 -103.80
REMARK 500 1 GLU A 43 -102.45 -108.84
REMARK 500 1 LEU A 45 -69.34 -94.76
REMARK 500 2 LYS A 3 72.71 53.05
REMARK 500 2 CYS A 4 172.08 50.36
REMARK 500 2 ILE A 5 -63.62 -101.56
REMARK 500 2 ALA A 6 60.57 78.65
REMARK 500 2 TYR A 9 36.86 76.14
REMARK 500 2 PRO A 18 -127.31 -68.23
REMARK 500 2 CYS A 20 -60.35 -94.67
REMARK 500 2 SER A 28 -126.36 -115.99
REMARK 500 2 MET A 30 -13.00 -156.32
REMARK 500 2 THR A 32 -146.59 -89.13
REMARK 500 2 ILE A 41 48.46 -99.62
REMARK 500 2 MET A 42 -30.92 -169.58
REMARK 500 2 GLU A 43 -117.87 -80.39
REMARK 500 2 LEU A 47 -61.86 -101.12
REMARK 500 3 LYS A 2 -159.03 48.03
REMARK 500 3 CYS A 4 169.36 57.73
REMARK 500 3 ILE A 5 -64.10 -96.60
REMARK 500 3 LYS A 7 123.66 -175.88
REMARK 500 3 TYR A 9 48.19 75.71
REMARK 500 3 CYS A 19 144.75 82.31
REMARK 500 3 CYS A 20 -68.53 -90.74
REMARK 500 3 ARG A 21 68.50 -111.36
REMARK 500 3 CYS A 25 38.22 82.34
REMARK 500 3 ILE A 29 77.23 89.06
REMARK 500 3 MET A 30 -51.04 177.21
REMARK 500 3 ILE A 41 56.88 -149.29
REMARK 500 3 MET A 42 -44.14 159.26
REMARK 500 3 LEU A 45 100.86 67.79
REMARK 500 3 LEU A 47 -57.18 -155.12
REMARK 500 4 LYS A 2 105.09 72.39
REMARK 500 4 LYS A 3 79.98 65.80
REMARK 500
REMARK 500 THIS ENTRY HAS 245 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 THR A 32 ASN A 33 4 -138.63
REMARK 500 ASN A 33 CYS A 34 4 -143.84
REMARK 500 THR A 32 ASN A 33 9 -148.20
REMARK 500 TRP A 14 GLY A 15 12 149.94
REMARK 500 LYS A 7 ASP A 8 13 -149.46
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 16 TYR A 9 0.07 SIDE CHAIN
REMARK 500
REMARK 500 REMARK: NULL
DBREF 1IVA A 1 48 UNP P30288 TOG4A_AGEAP 1 48
SEQRES 1 A 48 LYS LYS LYS CYS ILE ALA LYS ASP TYR GLY ARG CYS LYS
SEQRES 2 A 48 TRP GLY GLY THR PRO CYS CYS ARG GLY ARG GLY CYS ILE
SEQRES 3 A 48 CYS SER ILE MET GLY THR ASN CYS GLU CYS LYS PRO ARG
SEQRES 4 A 48 LEU ILE MET GLU GLY LEU GLY LEU ALA
SSBOND 1 CYS A 4 CYS A 20 1555 1555 1.98
SSBOND 2 CYS A 12 CYS A 25 1555 1555 1.99
SSBOND 3 CYS A 19 CYS A 36 1555 1555 2.00
SSBOND 4 CYS A 27 CYS A 34 1555 1555 1.99
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 - 23 20 Bytes