8TD1

Structure of PYCR1 complexed with 3-(6-Oxa-9-azaspiro(4.5)decane-9-carbonyl)benzoic acid

Summary for 8TD1

• Entry DOI: 10.2210/pdb8td1/pdb
• Descriptor: Pyrroline-5-carboxylate reductase 1, mitochondrial, 3-(6-oxa-9-azaspiro[4.5]decane-9-carbonyl)benzoic acid, DI(HYDROXYETHYL)ETHER, ... (5 entities in total)
• Functional Keywords: amino-acid biosynthesis, oxidoreductase, proline biosynthesis
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 5
• Total formula weight: 169599.87

Authors

Tanner, J.J.,Meeks, K.R. (deposition date: 2023-07-02, release date: 2024-03-06, Last modification date: 2024-03-20)

• Primary citation: Meeks, K.R.,Ji, J.,Protopopov, M.V.,Tarkhanova, O.O.,Moroz, Y.S.,Tanner, J.J.; Novel Fragment Inhibitors of PYCR1 from Docking-Guided X-ray Crystallography.; J.Chem.Inf.Model., 64:1704-1718, 2024; PubMed: 38411104; DOI: 10.1021/acs.jcim.3c01879

Experimental method

X-RAY DIFFRACTION (1.88 Å)