7P6N

ROCK2 IN COMPLEX WITH COMPOUND 12

7P6N の概要

• エントリーDOI: 10.2210/pdb7p6n/pdb
• 分子名称: Rho-associated protein kinase 2, ~{N}-[(1~{R})-1-(3-methoxyphenyl)ethyl]-4-pyridin-4-yl-piperidine-1-carboxamide (2 entities in total)
• 機能のキーワード: rho-associated protein kinase 2, inhibitor complex, transferase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 8
• 化学式量合計: 368322.76

構造登録者

Maillard, M.C. (登録日: 2021-07-16, 公開日: 2022-07-27, 最終更新日: 2024-06-19)

• 主引用文献: Ladduwahetty, T.,Lee, M.R.,Maillard, M.C.,Cachope, R.,Todd, D.,Barnes, M.,Beaumont, V.,Chauhan, A.,Gallati, C.,Haughan, A.F.,Kempf, G.,Luckhurst, C.A.,Matthews, K.,McAllister, G.,Mitchell, P.,Patel, H.,Rose, M.,Saville-Stones, E.,Steinbacher, S.,Stott, A.J.,Thatcher, E.,Tierney, J.,Urbonas, L.,Munoz-Sanjuan, I.,Dominguez, C.; Identification of a Potent, Selective, and Brain-Penetrant Rho Kinase Inhibitor and its Activity in a Mouse Model of Huntington's Disease.; J.Med.Chem., 65:9819-9845, 2022; PubMed: 35816678; DOI: 10.1021/acs.jmedchem.2c00474

実験手法

X-RAY DIFFRACTION (3 Å)