7WQS

Crystal structure of Aldo-keto reductase 1C3 complexed with compound 25

Summary for 7WQS

• Entry DOI: 10.2210/pdb7wqs/pdb
• Descriptor: Aldo-keto reductase family 1 member C3, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-~{N}-(3-methoxyphenyl)benzamide, ... (4 entities in total)
• Functional Keywords: aldo-keto reductase, lipid metabolism, nad, nadp, oxidoreductase
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 77661.80

Authors

Jiang, J.,Liu, Y.,He, S.,Chen, Y.,Chu, X.,Liu, Y.,Guo, Q.,Zhao, L.,Feng, F.,Liu, W.,Zhang, X.,Sun, H.,Fang, P. (deposition date: 2022-01-26, release date: 2023-01-04, Last modification date: 2023-11-29)

• Primary citation: Liu, Y.,Chen, Y.,Jiang, J.,Chu, X.,Guo, Q.,Zhao, L.,Feng, F.,Liu, W.,Zhang, X.,He, S.,Yang, P.,Fang, P.,Sun, H.; Development of highly potent and specific AKR1C3 inhibitors to restore the chemosensitivity of drug-resistant breast cancer.; Eur.J.Med.Chem., 247:115013-115013, 2022; PubMed: 36566714; DOI: 10.1016/j.ejmech.2022.115013

Experimental method

X-RAY DIFFRACTION (2.07 Å)