4P8H

Crystal structure of M. tuberculosis DprE1 in complex with the nitro-benzothiazole 6a

4P8H の概要

• エントリーDOI: 10.2210/pdb4p8h/pdb
• 関連するPDBエントリー: 4P8C 4P8K 4P8L 4P8M 4P8N 4P8P 4P8T 4P8Y
• 分子名称: Probable decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, {(4S)-2-[7-(hydroxyamino)-6-methyl-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-oxazol-4-yl}(pyrrolidin-1-yl)methanone, ... (4 entities in total)
• 機能のキーワード: dpre1, inhibitor, complex, covalent, nitro-benzothiazole 6a, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Mycobacterium tuberculosis
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 107182.57

構造登録者

Neres, J.,Cole, S.T. (登録日: 2014-03-31, 公開日: 2015-10-28, 最終更新日: 2023-12-27)

• 主引用文献: Neres, J.,Cole, S.T.; Non-mutagenic Nitrobenzothiazoles as Novel Anti-tubercular Agents: A Balance between Potency and Electron Affinity; To Be Published,

実験手法

X-RAY DIFFRACTION (3 Å)