4MUE

Crystal strcture of pantothenate synthetase in complex with 2-(5-methoxy-2-(4-(trifluoromethyl)phenylsulfonylcarbamoyl)-1H-indol-1-yl)acetic acid

4MUE の概要

• エントリーDOI: 10.2210/pdb4mue/pdb
• 関連するPDBエントリー: 4MQ6 4MUF 4MUG 4MUH 4MUI 4MUJ 4MUK 4MUL 4MUN
• 分子名称: Pantothenate synthetase, [5-methoxy-2-({[4-(trifluoromethyl)phenyl]sulfonyl}carbamoyl)-1H-indol-1-yl]acetic acid, ETHANOL, ... (5 entities in total)
• 機能のキーワード: alpha beta 3-layer(aba) sandwich rossmann fold, pantoate-ligase, atp binding, ligase-ligase inhibitor complex, ligase/ligase 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: 64585.65

構造登録者

Silvestre, H.L.,Blundell, T.L. (登録日: 2013-09-21, 公開日: 2014-08-27, 最終更新日: 2023-09-20)

• 主引用文献: Hung, A.W.,Silvestre, H.L.,Wen, S.,George, G.P.,Boland, J.,Blundell, T.L.,Ciulli, A.,Abell, C.; Optimization of Inhibitors of Mycobacterium tuberculosis Pantothenate Synthetase Based on Group Efficiency Analysis.; Chemmedchem, 11:38-42, 2016; PubMed: 26486566; DOI: 10.1002/cmdc.201500414

実験手法

X-RAY DIFFRACTION (2.06 Å)