4OSG

Klebsiella pneumoniae complexed with NADPH and 6-ethyl-5-[(3R)-3-[3-methoxyl-5-(pyridine-4-yl)phenyl]but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP1006)

4OSG の概要

• エントリーDOI: 10.2210/pdb4osg/pdb
• 関連するPDBエントリー: 4OR7
• 分子名称: Dihydrofolate reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 6-ethyl-5-{(3R)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine, ... (9 entities in total)
• 機能のキーワード: oxidoreductase, hydride shift, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Klebsiella pneumoniae CG43
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 80368.17

構造登録者

Lamb, K.M.,Anderson, A.C. (登録日: 2014-02-12, 公開日: 2014-12-03, 最終更新日: 2024-02-28)

• 主引用文献: Lamb, K.M.,Lombardo, M.N.,Alverson, J.,Priestley, N.D.,Wright, D.L.,Anderson, A.C.; Crystal Structures of Klebsiella pneumoniae Dihydrofolate Reductase Bound to Propargyl-Linked Antifolates Reveal Features for Potency and Selectivity.; Antimicrob.Agents Chemother., 58:7484-7491, 2014; PubMed: 25288083; DOI: 10.1128/AAC.03555-14

実験手法

X-RAY DIFFRACTION (2.7 Å)