Brand  (β version)

color scheme of protein:

hetatm:

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information
centroid:
interaction residue:

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Ligands
Code Name Link
0M3 (3s,5r)-N-(2,2-diphenylethyl)-5-{[(4-methylphenyl)sulfonyl]amino}piperidine-3-carboxamide
NAG N-acetyl-D-glucosamine
SO4 Sulfate ion
Code : 4GJA
Header : HYDROLASE/HYDROLASE INHIBITOR
Title : Crystal structure of renin in complex with NVP-AYL747 (compound 5)
Release Data : 2013-02-13
Compound :
mol_id molecule chains synonym
1 Renin A,B Angiotensinogenase
ec: 3.4.23.15
fragment: UNP residues 67-406
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Cricetulus griseus  (taxid:10029)
gene: REN
expression_system_common: Chinese hamster
Authors : Ostermann, N., Zink, F., Kroemer, M.
Keywords : renin inhibitor, fragment based screening, 3, 5-disubstituted piperidines, HYDROLASE-HYDROLASE INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 2.60 Å )
Citation :

A novel class of oral direct Renin inhibitors: highly potent 3,5-disubstituted piperidines bearing a tricyclic p3-p1 pharmacophore.

Ostermann, N.,Ruedisser, S.,Ehrhardt, C.  et al.
(2013)  J.Med.Chem.  56 : 2196 - 2206

PubMed: 23360239
DOI: 10.1021/jm301706j

Chain : A, B
UniProt : P00797 (RENI_HUMAN)
Reaction : Cleavage of Leu-|-Xaa bond in angiotensinogen to generate angiotensin I.