遇见数据集

ROCK1 IN COMPLEX WITH LIGAND G5018

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Protein Data Bank Japan2024-05-22 更新2026-04-19 收录
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ROCK1 IN COMPLEX WITH LIGAND G5018 Descriptor: 2-[methyl(phenyl)amino]-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridin-1(2H)-yl]ethan-1-one, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Rho-associated protein kinase 1 Authors: Ganichkin, O, Harris, S.F, Steinbacher, S. Deposit date: 2021-09-03 Release date: 2022-10-05 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.744 Å) Cite: Chemical space docking enables large-scale structure-based virtual screening to discover ROCK1 kinase inhibitors. Nat Commun, 13, 2022

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2021-09-03
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