6XCE

Structure of the C. botulinum neurotoxin serotype A light chain protease in complex with covalent inhibitor 53

6XCE の概要

• エントリーDOI: 10.2210/pdb6xce/pdb
• 分子名称: Botulinum neurotoxin type A, (3S)-3-(2,4-dichlorophenyl)-N~1~-hydroxy-N~5~-(3-sulfanylpropyl)pentanediamide (3 entities in total)
• 機能のキーワード: covalent inhibitor, hydroxamate, toxin, toxin-inhibitor complex, toxin/inhibitor
• 由来する生物種: Clostridium botulinum
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 50820.15

構造登録者

Tararina, M.A.,Allen, K.N. (登録日: 2020-06-08, 公開日: 2020-09-23, 最終更新日: 2023-10-18)

• 主引用文献: Lin, L.,Olson, M.E.,Sugane, T.,Turner, L.D.,Tararina, M.A.,Nielsen, A.L.,Kurbanov, E.K.,Pellett, S.,Johnson, E.A.,Cohen, S.M.,Allen, K.N.,Janda, K.D.; Catch and Anchor Approach To Combat Both Toxicity and Longevity of Botulinum Toxin A.; J.Med.Chem., 63:11100-11120, 2020; PubMed: 32886509; DOI: 10.1021/acs.jmedchem.0c01006

実験手法

X-RAY DIFFRACTION (2.5 Å)