8GDS

CRYSTAL STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE 2 (ROCK2) IN COMPLEX WITH 4-(4-(2-(2,3-DIHYDRO-1H- INDOL-1-YL)-2-OXOETHYL)PHENYL)-1(2H)-PHTHALAZINONE

Summary for 8GDS

Entry DOI	10.2210/pdb8gds/pdb
Descriptor	Rho-associated protein kinase 2, 4-{4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]phenyl}phthalazin-1(2H)-one, SULFATE ION, ... (4 entities in total)
Functional Keywords	rock-2, rho kinase 2, rho-associated, coiled-coil-containing protein kinase ii, kinase, ligand inhibitor, transferase
Biological source	Homo sapiens (human)
Total number of polymer chains	4
Total formula weight	185045.69
Authors	Muckelbauer, J.K. (deposition date: 2023-03-06, release date: 2023-05-10, Last modification date: 2023-05-17)
Primary citation	Hu, Z.,Sitkoff, D.,Glunz, P.W.,Zou, Y.,Wang, C.,Muckelbauer, J.K.,Adam, L.P.,Wexler, R.R.,Quan, M.L. Phthalazinone-based lactams and cyclic ureas as ROCK2 selective inhibitors. Bioorg.Med.Chem.Lett., 88:129304-129304, 2023 Cited by PubMed: 37119973 DOI: 10.1016/j.bmcl.2023.129304 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.71 Å)

Structure validation