7THF

Structure of Cyclophilin D Peptidyl-Prolyl Isomerase Domain bound to Macrocyclic Inhibitor B53

7THF の概要

• エントリーDOI: 10.2210/pdb7thf/pdb
• 関連するPDBエントリー: 7TGS 7TGT 7TGU 7TGV 7TH1 7TH6 7TH7 7THC 7THD
• 分子名称: Peptidyl-prolyl cis-trans isomerase F, mitochondrial, 3-(4'-{[(4S,7S,11R,13E,19S)-19-{[2-(2-aminoethoxy)ethyl]carbamoyl}-7-benzyl-3,6,12,15,21-pentaoxo-1,3,4,5,6,7,8,9,10,12,15,16,17,18,19,20,21,22-octadecahydro-2H-7,11-methano-2,5,11,16,20-benzopentaazacyclotetracosin-4-yl]methyl}[1,1'-biphenyl]-4-yl)pentanedioic acid (3 entities in total)
• 機能のキーワード: oxidative stress, necrosis, mitochondrial permeability, isomerase, isomerase-isomerase inhibitor complex, isomerase/isomerase inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 18638.24

構造登録者

Rangwala, A.M.,Thakur, M.K.,Seeliger, M.A.,Peterson, A.A.,Liu, D.R. (登録日: 2022-01-10, 公開日: 2022-08-24, 最終更新日: 2023-10-18)

• 主引用文献: Peterson, A.A.,Rangwala, A.M.,Thakur, M.K.,Ward, P.S.,Hung, C.,Outhwaite, I.R.,Chan, A.I.,Usanov, D.L.,Mootha, V.K.,Seeliger, M.A.,Liu, D.R.; Discovery and molecular basis of subtype-selective cyclophilin inhibitors.; Nat.Chem.Biol., 18:1184-1195, 2022; PubMed: 36163383; DOI: 10.1038/s41589-022-01116-1

実験手法

X-RAY DIFFRACTION (1.1 Å)