5KOQ

Discovery of TAK-272: A Novel, Potent and Orally Active Renin In-hibitor

Summary for 5KOQ

Entry DOI	10.2210/pdb5koq/pdb
Related	5KOS 5KOT
Descriptor	Renin, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-~{tert}-butyl-4-(furan-2-ylmethylamino)-~{N}-(2-methylpropyl)-~{N}-[(3~{S})-piperidin-3-yl]pyrimidine-5-carboxamide, ... (5 entities in total)
Functional Keywords	protein-inhibitor complex, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (Human)
Cellular location	Secreted: P00797
Total number of polymer chains	2
Total formula weight	75254.84
Authors	Snell, G.P.,Behnke, C.A.,Okada, K.,Hideyuki, O.,Sang, B.-C.,Lane, W. (deposition date: 2016-07-01, release date: 2016-11-02, Last modification date: 2020-07-29)
Primary citation	Imaeda, Y.,Tawada, M.,Suzuki, S.,Tomimoto, M.,Kondo, M.,Tarui, N.,Sanada, T.,Kanagawa, R.,Snell, G.,Behnke, C.A.,Kubo, K.,Kuroita, T. Structure-based design of a new series of N-(piperidin-3-yl)pyrimidine-5-carboxamides as renin inhibitors. Bioorg.Med.Chem., 24:5771-5780, 2016 Cited by PubMed: 27687967 DOI: 10.1016/j.bmc.2016.09.030 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.7 Å)

Structure validation