6R7D

Crystal structure of LTC4S in complex with AZ13690257

6R7D の概要

• エントリーDOI: 10.2210/pdb6r7d/pdb
• 分子名称: Leukotriene C4 synthase, (1~{S},2~{S})-2-[5-[cyclopropylmethyl(naphthalen-1-yl)amino]-4-methoxy-pyrimidin-2-yl]carbonylcyclopropane-1-carboxylic acid, NICKEL (II) ION, ... (6 entities in total)
• 機能のキーワード: inhibitor, arachidonic acid cascade, cysteinyl leukotrienes, membrane protein
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 12
• 化学式量合計: 226807.33

構造登録者

Kack, H.,Ek, M. (登録日: 2019-03-28, 公開日: 2019-08-28, 最終更新日: 2024-01-24)

• 主引用文献: Munck Af Rosenschold, M.,Johannesson, P.,Nikitidis, A.,Tyrchan, C.,Chang, H.F.,Ronn, R.,Chapman, D.,Ullah, V.,Nikitidis, G.,Glader, P.,Kack, H.,Bonn, B.,Wagberg, F.,Bjorkstrand, E.,Andersson, U.,Swedin, L.,Rohman, M.,Andreasson, T.,Bergstrom, E.L.,Jiang, F.,Zhou, X.H.,Lundqvist, A.J.,Malmberg, A.,Ek, M.,Gordon, E.,Pettersen, A.,Ripa, L.,Davis, A.M.; Discovery of the Oral Leukotriene C4 Synthase Inhibitor (1S,2S)-2-({5-[(5-Chloro-2,4-difluorophenyl)(2-fluoro-2-methylpropyl)amino]-3-methoxypyrazin-2-yl}carbonyl)cyclopropanecarboxylic Acid (AZD9898) as a New Treatment for Asthma.; J.Med.Chem., 62:7769-7787, 2019; PubMed: 31415176; DOI: 10.1021/acs.jmedchem.9b00555

実験手法

X-RAY DIFFRACTION (2.35 Å)