2WD7

PTERIDINE REDUCTASE 1 (PTR1) FROM TRYPANOSOMA BRUCEI IN COMPLEX WITH NADP AND DDD00066750

2WD7 の概要

• エントリーDOI: 10.2210/pdb2wd7/pdb
• 関連するPDBエントリー: 2C7V 2VZ0 2WD8
• 分子名称: PTERIDINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 6-chloro-1H-benzimidazol-2-amine, ... (5 entities in total)
• 機能のキーワード: short-chain dehydrogenase/reductase, drug discovery, oxidoreductase, trypanosomatids, pteridine reductase, methotrexate resistance
• 由来する生物種: TRYPANOSOMA BRUCEI BRUCEI; 詳細
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 117685.77

構造登録者

Robinson, D.A.,Wyatt, P.G.,Spinks, D.,Brenk, R. (登録日: 2009-03-20, 公開日: 2009-06-30, 最終更新日: 2023-12-13)

• 主引用文献: Mpamhanga, C.P.,Spinks, D.,Tulloch, L.B.,Shanks, E.J.,Robinson, D.A.,Collie, I.T.,Fairlamb, A.H.,Wyatt, P.G.,Frearson, J.A.,Hunter, W.N.,Gilbert, I.H.,Brenk, R.; One Scaffold, Three Binding Modes: Novel and Selective Pteridine Reductase 1 Inhibitors Derived from Fragment Hits Discovered by Virtual Screening.; J.Med.Chem., 52:4454-, 2009; PubMed: 19527033; DOI: 10.1021/JM900414X

実験手法

X-RAY DIFFRACTION (1.9 Å)