3GW5

Crystal structure of human renin complexed with a novel inhibitor

Summary for 3GW5

Entry DOI	10.2210/pdb3gw5/pdb
Descriptor	Renin, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, (3R)-3-[(1S)-1-(3-chlorophenyl)-1-hydroxy-5-methoxypentyl]-N-{(1S)-2-cyclohexyl-1-[(methylamino)methyl]ethyl}piperidine-1-carboxamide, ... (7 entities in total)
Functional Keywords	renin, aspartate protease, hypertension, renin expression, renin inhibitor, aspartyl protease, cleavage on pair of basic residues, disease mutation, disulfide bond, glycoprotein, hydrolase, membrane, protease, secreted, zymogen, 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	76036.99
Authors	Wu, Z.,McKeever, B.M. (deposition date: 2009-03-31, release date: 2009-06-23, Last modification date: 2023-09-06)
Primary citation	Tice, C.M.,Xu, Z.,Yuan, J.,Simpson, R.D.,Cacatian, S.T.,Flaherty, P.T.,Zhao, W.,Guo, J.,Ishchenko, A.,Singh, S.B.,Wu, Z.,Scott, B.B.,Bukhtiyarov, Y.,Berbaum, J.,Mason, J.,Panemangalore, R.,Cappiello, M.G.,Muller, D.,Harrison, R.K.,McGeehan, G.M.,Dillard, L.W.,Baldwin, J.J.,Claremon, D.A. Design and optimization of renin inhibitors: Orally bioavailable alkyl amines. Bioorg.Med.Chem.Lett., 19:3541-3545, 2009 Cited by PubMed: 19457666 DOI: 10.1016/j.bmcl.2009.04.140 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation