8JUB

Crystal structure of glutaminase C in complex with compound 27

Summary for 8JUB

Entry DOI	10.2210/pdb8jub/pdb
Descriptor	Glutaminase kidney isoform, mitochondrial, 3-[2-oxidanylidene-2-[[5-[[(3R)-1-pyridazin-3-ylpyrrolidin-3-yl]amino]-1,3,4-thiadiazol-2-yl]amino]ethyl]benzoic acid (3 entities in total)
Functional Keywords	inhibitor, complex, antitumor protein, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (human)
Total number of polymer chains	4
Total formula weight	235974.36
Authors	Wang, X.,Hanyu, S.,Tingting, D. (deposition date: 2023-06-26, release date: 2023-10-11, Last modification date: 2023-11-01)
Primary citation	Sun, H.,Du, T.,Yang, M.,Liu, X.,Xue, X.,Chen, K.,Lang, X.,Chen, X.,Wang, B.,Wang, X. Targeting the Subpocket Enables the Discovery of Thiadiazole-Pyridazine Derivatives as Glutaminase C Inhibitors. Acs Med.Chem.Lett., 14:1455-1466, 2023 Cited by PubMed: 37849538 DOI: 10.1021/acsmedchemlett.3c00375 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.01 Å)

Structure validation