4W7P

Crystal Structure of ROCK 1 bound to YB-15-QD37

Summary for 4W7P

Entry DOI	10.2210/pdb4w7p/pdb
Descriptor	Rho-associated protein kinase 1, N~1~-[2-(1H-indazol-5-yl)pyrido[3,4-d]pyrimidin-4-yl]-2-methylpropane-1,2-diamine (3 entities in total)
Functional Keywords	inhibitor, kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Homo sapiens (Human)
Cellular location	Cytoplasm: Q13464
Total number of polymer chains	4
Total formula weight	190839.59
Authors	Sprague, E.R. (deposition date: 2014-08-22, release date: 2014-10-15, Last modification date: 2023-12-27)
Primary citation	Shaw, D.,Hollingworth, G.,Soldermann, N.,Sprague, E.,Schuler, W.,Vangrevelinghe, E.,Duggan, N.,Thomas, M.,Kosaka, T.,Waters, N.,van Eis, M.J. Novel ROCK inhibitors for the treatment of pulmonary arterial hypertension. Bioorg.Med.Chem.Lett., 24:4812-4817, 2014 Cited by PubMed: 25248678 DOI: 10.1016/j.bmcl.2014.09.002 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.8 Å)

Structure validation