1RSI

DHNA complex with 2-Amino-5-bromo-3-hydroxy-6-phenylpyrimidine

1RSI の概要

• エントリーDOI: 10.2210/pdb1rsi/pdb
• 関連するPDBエントリー: 1RR5 1RRI 1RRW 1RRY 1RS2 1RS4 1RSD
• 分子名称: Dihydroneopterin aldolase, 2-AMINO-5-BROMO-6-PHENYLPYRIMIDIN-4-OL (2 entities in total)
• 機能のキーワード: dhna, 7, 8-dihydroneopterin aldolase, 2-amino-5-bromo-3-hydroxy-6-phenylpyrimidine, lyase
• 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: 14035.73

構造登録者

Sanders, W.J.,Nienaber, V.L.,Lerner, C.G.,McCall, J.O.,Merrick, S.M.,Swanson, S.J.,Harlan, J.E.,Stoll, V.S.,Stamper, G.F.,Betz, S.F.,Condroski, K.R.,Meadows, R.P.,Severin, J.M.,Walter, K.A.,Magdalinos, P.,Jakob, C.G.,Wagner, R.,Beutel, B.A. (登録日: 2003-12-09, 公開日: 2004-03-30, 最終更新日: 2024-02-14)

• 主引用文献: Sanders, W.J.,Nienaber, V.L.,Lerner, C.G.,McCall, J.O.,Merrick, S.M.,Swanson, S.J.,Harlan, J.E.,Stoll, V.S.,Stamper, G.F.,Betz, S.F.,Condroski, K.R.,Meadows, R.P.,Severin, J.M.,Walter, K.A.,Magdalinos, P.,Jakob, C.G.,Wagner, R.,Beutel, B.A.; Discovery of Potent Inhibitors of Dihydroneopterin Aldolase Using CrystaLEAD High-Throughput X-ray Crystallographic Screening and Structure-Directed Lead Optimization.; J.Med.Chem., 47:1709-1718, 2004; PubMed: 15027862; DOI: 10.1021/jm030497y

実験手法

X-RAY DIFFRACTION (2.2 Å)