7S26

ROCK1 IN COMPLEX WITH LIGAND G5018

7S26 の概要

• エントリーDOI: 10.2210/pdb7s26/pdb
• 分子名称: Rho-associated protein kinase 1, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 2-[methyl(phenyl)amino]-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridin-1(2H)-yl]ethan-1-one, ... (4 entities in total)
• 機能のキーワード: rho kinase, proteros biostructures gmbh, transferase
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 185552.20

構造登録者

Ganichkin, O.,Harris, S.F.,Steinbacher, S. (登録日: 2021-09-03, 公開日: 2022-10-05, 最終更新日: 2024-05-22)

• 主引用文献: Beroza, P.,Crawford, J.J.,Ganichkin, O.,Gendelev, L.,Harris, S.F.,Klein, R.,Miu, A.,Steinbacher, S.,Klingler, F.M.,Lemmen, C.; Chemical space docking enables large-scale structure-based virtual screening to discover ROCK1 kinase inhibitors.; Nat Commun, 13:6447-6447, 2022; PubMed: 36307407; DOI: 10.1038/s41467-022-33981-8

実験手法

X-RAY DIFFRACTION (2.744 Å)