6BQ0

Structure of human monoacylglycerol lipase bound to a covalent inhibitor

6BQ0 の概要

• エントリーDOI: 10.2210/pdb6bq0/pdb
• 分子名称: Monoglyceride lipase, 1-({(1R,5S,6r)-6-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]-3-azabicyclo[3.1.0]hexane-3-carbonyl}oxy)pyrrolidine-2,5-dione (3 entities in total)
• 機能のキーワード: monoacylglycerol lipase, covalent inhibitor, sbdd, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Cytoplasm, cytosol : Q99685
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 77286.10

構造登録者

Pandit, J. (登録日: 2017-11-27, 公開日: 2018-03-14, 最終更新日: 2023-10-04)

• 主引用文献: McAllister, L.A.,Butler, C.R.,Mente, S.,O'Neil, S.V.,Fonseca, K.R.,Piro, J.R.,Cianfrogna, J.A.,Foley, T.L.,Gilbert, A.M.,Harris, A.R.,Helal, C.J.,Johnson, D.S.,Montgomery, J.I.,Nason, D.M.,Noell, S.,Pandit, J.,Rogers, B.N.,Samad, T.A.,Shaffer, C.L.,da Silva, R.G.,Uccello, D.P.,Webb, D.,Brodney, M.A.; Discovery of Trifluoromethyl Glycol Carbamates as Potent and Selective Covalent Monoacylglycerol Lipase (MAGL) Inhibitors for Treatment of Neuroinflammation.; J. Med. Chem., 61:3008-3026, 2018; PubMed: 29498843; DOI: 10.1021/acs.jmedchem.8b00070

実験手法

X-RAY DIFFRACTION (2 Å)