7RTQ

Sterol 14alpha demethylase (CYP51) from Naegleria fowleri in complex with an inhibitor R)-N-(1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

7RTQ の概要

• エントリーDOI: 10.2210/pdb7rtq/pdb
• 分子名称: Protein CYP51, PROTOPORPHYRIN IX CONTAINING FE, N-[(1R)-2-(1H-imidazol-1-yl)-1-(3,4',5-trifluoro[1,1'-biphenyl]-4-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide, ... (4 entities in total)
• 機能のキーワード: cytochrome p450, cyp51, sterol 14 alpha- demethylase, oxidoreductase
• 由来する生物種: Naegleria fowleri (Brain eating amoeba)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 218968.10

構造登録者

Lepesheva, G.I.,Hargrove, T.Y.,Wawrzak, Z. (登録日: 2021-08-13, 公開日: 2021-11-24, 最終更新日: 2023-10-18)

• 主引用文献: Hargrove, T.Y.,Wawrzak, Z.,Rachakonda, G.,Nes, W.D.,Villalta, F.,Guengerich, F.P.,Lepesheva, G.I.; Relaxed Substrate Requirements of Sterol 14 alpha-Demethylase from Naegleria fowleri Are Accompanied by Resistance to Inhibition.; J.Med.Chem., 64:17511-17522, 2021; PubMed: 34842434; DOI: 10.1021/acs.jmedchem.1c01710

実験手法

X-RAY DIFFRACTION (2.11 Å)