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TitleDesign and optimization of new piperidines as renin inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 20, Page 6286-6290, Year 2010
Publish dateAug 4, 2010 (structure data deposition date)
AuthorsCorminboeuf, O. / Bezencon, O. / Grisostomi, C. / Remen, L. / Richard-Bildstein, S. / Bur, D. / Prade, L. / Hess, P. / Strickner, P. / Fischli, W. ...Corminboeuf, O. / Bezencon, O. / Grisostomi, C. / Remen, L. / Richard-Bildstein, S. / Bur, D. / Prade, L. / Hess, P. / Strickner, P. / Fischli, W. / Steiner, B. / Treiber, A.
External linksBioorg. Med. Chem. Lett. / PubMed:20843686
MethodsX-ray diffraction
Resolution2.17 - 2.4 Å
Structure data

PDB-3o9l:
Design and optimisation of new piperidines as renin inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-3oad:
Design and optimization of new piperidines as renin inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.17 Å

PDB-3oag:
Design and optimization of new piperidines as renin inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-LPN:
(3R,4S)-N-[2-chloro-5-(3-methoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl}piperidine-3-carboxamide

ChemComp-HOH:
WATER

ChemComp-LPO:
(3S,4R)-N-[2-chloro-5-(2-methoxyethyl)benzyl]-N-cyclopropyl-4-{6-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]pyridin-3-yl}-4-hydroxypiperidine-3-carboxamide

ChemComp-LPQ:
(3R,4S)-N-{2-chloro-5-[(cyclopropylamino)methyl]benzyl}-N-cyclopropyl-4-{6-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]pyridin-3-yl}piperidine-3-carboxamide

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / Hydrolase / Protease / Glycosilation / Blood / HYDROLASE-HYDROLASE INHIBITOR complex / HYDROLASE / HYDROLASE INHIBITOR / HYDROLASE - HYDROLASE INHIBITOR complex

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