4PYV

Crystal structure of renin in complex with compound4

Summary for 4PYV

Entry DOI	10.2210/pdb4pyv/pdb
Descriptor	Renin, 2-acetamido-2-deoxy-beta-D-glucopyranose, tert-butyl {(3S,5R)-5-[cyclopropyl(2,3-dichlorobenzyl)carbamoyl]piperidin-3-yl}carbamate, ... (6 entities in total)
Functional Keywords	renin inhibitor, 3, 5-substituted piperidines, hydrolase inhibitor complex, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens
Cellular location	Secreted: P00797
Total number of polymer chains	2
Total formula weight	75970.44
Authors	Ostermann, N.,Zink, F. (deposition date: 2014-03-28, release date: 2014-10-08, Last modification date: 2020-07-29)
Primary citation	Ehara, T.,Irie, O.,Kosaka, T.,Kanazawa, T.,Breitenstein, W.,Grosche, P.,Ostermann, N.,Suzuki, M.,Kawakami, S.,Konishi, K.,Hitomi, Y.,Toyao, A.,Gunji, H.,Cumin, F.,Schiering, N.,Wagner, T.,Rigel, D.F.,Webb, R.L.,Maibaum, J.,Yokokawa, F. Structure-based design of substituted piperidines as a new class of highly efficacious oral direct Renin inhibitors. ACS Med Chem Lett, 5:787-792, 2014 Cited by PubMed: 25050166 DOI: 10.1021/ml500137b PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.65 Å)

Structure validation