7Q28

Crystal structure of Angiotensin-1 converting enzyme C-domain in complex with dual ACE/NEP inhibitor AD012

Summary for 7Q28

• Entry DOI: 10.2210/pdb7q28/pdb
• Descriptor: Angiotensin-converting enzyme, alpha-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... (10 entities in total)
• Functional Keywords: angiotensin-1 converting enzyme, dual inhibitor, nep, metalloprotease, hydrolase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 70986.51

Authors

Cozier, G.E.,Acharya, K.R. (deposition date: 2021-10-23, release date: 2022-02-16, Last modification date: 2024-01-31)

• Primary citation: Arendse, L.B.,Cozier, G.E.,Eyermann, C.J.,Basarab, G.S.,Schwager, S.L.,Chibale, K.,Acharya, K.R.,Sturrock, E.D.; Probing the Requirements for Dual Angiotensin-Converting Enzyme C-Domain Selective/Neprilysin Inhibition.; J.Med.Chem., 65:3371-3387, 2022; PubMed: 35113565; DOI: 10.1021/acs.jmedchem.1c01924

Experimental method

X-RAY DIFFRACTION (1.65 Å)