NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
17230 | 2btx | 4195 | cing | 1-original | MR format | comment |
*HEADER COMPLEX (TOXIN/PEPTIDE) 23-AUG-98 2BTX *TITLE SOLUTION NMR STRUCTURE OF THE COMPLEX OF ALPHA-BUNGAROTOXIN *TITLE 2 WITH A LIBRARY DERIVED PEPTIDE, NMR, MINIMIZED AVERAGE *TITLE 3 STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ALPHA-BUNGAROTOXIN; *COMPND 3 CHAIN: A; *COMPND 4 BIOLOGICAL_UNIT: MONOMER; *COMPND 5 MOL_ID: 2; *COMPND 6 MOLECULE: *COMPND 7 MET-ARG-TYR-TYR-GLU-SER-SER-LEU-LYS-SER-TYR-PRO-ASP; *COMPND 8 CHAIN: B; *COMPND 9 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: BUNGARUS MULTICINCTUS; *SOURCE 3 ORGANISM_COMMON: SNAKE, MANY-BANDED KRAIT; *SOURCE 4 SECRETION: VENOM; *SOURCE 5 MOL_ID: 2; *SOURCE 6 SYNTHETIC: DERIVED FROM A PHAGE-DISPLAYED PEPTIDE LIBRARY *KEYWDS COMPLEX (TOXIN/PEPTIDE), ALPHA-BUNGAROTOXIN, LIBRARY PEPTIDE *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR T.SCHERF,M.BALASS,S.FUCHS,E.KATCHALSKI-KATZIR,J.ANGLISTER *REVDAT 1 12-OCT-04 2BTX 0 !A LIST OF ALL NMR CONSTRAINTS USED TO CALCULATE THE THREE-DIMENSIONAL SOLUTION !STRUCTURE OF THE COMPLEX OF a-BUNGAROTOXIN WITH A LIBRARY-DERIVED PEPTIDE. !THESE CONSTRAINTS CONSISTED OF 941 INTRAMOLECULAR !CONSTRAINTS WITHIN THE BOUND TOXIN (INCLUDING 291 LONG-RANGE !INTERACTIONS), 98 INTRAPEPTIDE INTERACTIONS (INCLUDING 7 LONG- !RANGE INTERACTIONS), AND 62 INTERMOLECULAR CONSTRAINTS BETWEEN !THE BUNGAROTOXIN AND THE 13-RESIDUE PEPTIDE USED IN THIS !STUDY (LISTED HERE AS RESIDUES 75 - 87).
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