4XEC

Staphylococcus aureus Dihydrofolate Reductase complexed with NADPH and 6-ETHYL-5-[(3R)-3-[3-METHOXY-5-(PYRIDIN-4-YL)PHENYL]BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE (UCP1061)

4XEC の概要

• エントリーDOI: 10.2210/pdb4xec/pdb
• 分子名称: Dihydrofolate reductase, 6-ethyl-5-{(3R)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine, ACETATE ION, ... (5 entities in total)
• 機能のキーワード: dihydrofolate reductase, oxidoreductase, methicillin-resistant staphylococcus aureus, antifolates, enantiopure inhibitors, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Staphylococcus aureus
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 19193.47

構造登録者

Reeve, S.M.,Anderson, A.C. (登録日: 2014-12-23, 公開日: 2015-07-22, 最終更新日: 2023-09-27)

• 主引用文献: Keshipeddy, S.,Reeve, S.M.,Anderson, A.C.,Wright, D.L.; Nonracemic Antifolates Stereoselectively Recruit Alternate Cofactors and Overcome Resistance in S. aureus.; J.Am.Chem.Soc., 137:8983-8990, 2015; PubMed: 26098608; DOI: 10.1021/jacs.5b01442

実験手法

X-RAY DIFFRACTION (2.692 Å)