7OSQ

Crystal structure of UDP-N-acetylenolpyruvoylglucosamine reductase (MurB) from Pseudomonas aeruginosa in complex with FAD and a pyrazole derivative (fragment 18)

7OSQ の概要

• エントリーDOI: 10.2210/pdb7osq/pdb
• 関連するPDBエントリー: 7OR2 7ORZ
• 分子名称: UDP-N-acetylenolpyruvoylglucosamine reductase, FLAVIN-ADENINE DINUCLEOTIDE, 5-methyl-1-phenyl-1,2,3-triazole-4-carboxylic acid, ... (4 entities in total)
• 機能のキーワード: peptidoglycan-biosynthesis, fragment based drug discovery, oxidoreductase
• 由来する生物種: Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 38667.61

構造登録者

Acebron-Garcia de Eulate, M.,Mayol-Llinas, J.,Blundell, T.L.,Kim, S.Y.,Mendes, V.,Abell, C. (登録日: 2021-06-09, 公開日: 2021-11-03, 最終更新日: 2024-01-31)

• 主引用文献: Acebron-Garcia-de-Eulate, M.,Mayol-Llinas, J.,Holland, M.T.O.,Kim, S.Y.,Brown, K.P.,Marchetti, C.,Hess, J.,Di Pietro, O.,Mendes, V.,Abell, C.,Floto, R.A.,Coyne, A.G.,Blundell, T.L.; Discovery of Novel Inhibitors of Uridine Diphosphate- N -Acetylenolpyruvylglucosamine Reductase (MurB) from Pseudomonas aeruginosa , an Opportunistic Infectious Agent Causing Death in Cystic Fibrosis Patients.; J.Med.Chem., 65:2149-2173, 2022; PubMed: 35080396; DOI: 10.1021/acs.jmedchem.1c01684

実験手法

X-RAY DIFFRACTION (2.07 Å)