4IGE

Crystal structure of Plasmodium falciparum FabI complexed with NAD and inhibitor 7-(4-Chloro-2-hydroxyphenoxy)-4-methyl-2H-chromen-2-one

4IGE の概要

• エントリーDOI: 10.2210/pdb4ige/pdb
• 関連するPDBエントリー: 4IGF
• 分子名称: Enoyl-acyl carrier reductase, 7-(4-chloro-2-hydroxyphenoxy)-4-methyl-2H-chromen-2-one, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... (6 entities in total)
• 機能のキーワード: reductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Plasmodium falciparum
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 81031.29

構造登録者

Kostrewa, D.,Perozzo, R. (登録日: 2012-12-17, 公開日: 2013-11-06, 最終更新日: 2023-11-08)

• 主引用文献: Belluti, F.,Perozzo, R.,Lauciello, L.,Colizzi, F.,Kostrewa, D.,Bisi, A.,Gobbi, S.,Rampa, A.,Bolognesi, M.L.,Recanatini, M.,Brun, R.,Scapozza, L.,Cavalli, A.; Design, Synthesis, and Biological and Crystallographic Evaluation of Novel Inhibitors of Plasmodium falciparum Enoyl-ACP-reductase (PfFabI); J.Med.Chem., 56:7516-7526, 2013; PubMed: 24063369; DOI: 10.1021/jm400637m

実験手法

X-RAY DIFFRACTION (2.15 Å)