5U7J

PDE2 catalytic domain complexed with inhibitors

5U7J の概要

• エントリーDOI: 10.2210/pdb5u7j/pdb
• 関連するPDBエントリー: 5U7D 5U7I 5U7K 5U7L
• 分子名称: cGMP-dependent 3',5'-cyclic phosphodiesterase, 5-[2-(2-methoxyphenyl)ethoxy]-3-(2-methylpropyl)[1,2,4]triazolo[4,3-a]pyrazine, ZINC ION, ... (5 entities in total)
• 機能のキーワード: pde2, sbdd, inhibitor, phosphodiesterase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Isoform PDE2A3: Cell membrane ; Lipid-anchor . Isoform PDE2A2: Mitochondrion matrix . Isoform PDE2A1: Cytoplasm . Isoform 5: Mitochondrion : O00408
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 162564.84

構造登録者

Pandit, J.,Parris, K. (登録日: 2016-12-12, 公開日: 2017-06-28, 最終更新日: 2023-10-04)

• 主引用文献: Helal, C.J.,Arnold, E.P.,Boyden, T.L.,Chang, C.,Chappie, T.A.,Fennell, K.F.,Forman, M.D.,Hajos, M.,Harms, J.F.,Hoffman, W.E.,Humphrey, J.M.,Kang, Z.,Kleiman, R.J.,Kormos, B.L.,Lee, C.W.,Lu, J.,Maklad, N.,McDowell, L.,Mente, S.,O'Connor, R.E.,Pandit, J.,Piotrowski, M.,Schmidt, A.W.,Schmidt, C.J.,Ueno, H.,Verhoest, P.R.,Yang, E.X.; Application of Structure-Based Design and Parallel Chemistry to Identify a Potent, Selective, and Brain Penetrant Phosphodiesterase 2A Inhibitor.; J. Med. Chem., 60:5673-5698, 2017; PubMed: 28574706; DOI: 10.1021/acs.jmedchem.7b00397

実験手法

X-RAY DIFFRACTION (1.9 Å)