8QE3

Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 31

Summary for 8QE3

Entry DOI	10.2210/pdb8qe3/pdb
Descriptor	S-adenosylmethionine synthase isoform type-2, 3-cyclopropyl-6-(2-methylindazol-5-yl)-4-(6-methylpyridin-3-yl)-2~{H}-pyrazolo[4,3-b]pyridin-5-one, S-ADENOSYLMETHIONINE, ... (4 entities in total)
Functional Keywords	s-adenosylmethionine biosynthesis, allosteric inhibitor, transferase
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	44730.71
Authors	Schimpl, M. (deposition date: 2023-08-30, release date: 2024-03-20, Last modification date: 2024-04-10)
Primary citation	Atkinson, S.J.,Bagal, S.K.,Argyrou, A.,Askin, S.,Cheung, T.,Chiarparin, E.,Coen, M.,Collie, I.T.,Dale, I.L.,De Fusco, C.,Dillman, K.,Evans, L.,Feron, L.J.,Foster, A.J.,Grondine, M.,Kantae, V.,Lamont, G.M.,Lamont, S.,Lynch, J.T.,Nilsson Lill, S.,Robb, G.R.,Saeh, J.,Schimpl, M.,Scott, J.S.,Smith, J.,Srinivasan, B.,Tentarelli, S.,Vazquez-Chantada, M.,Wagner, D.,Walsh, J.J.,Watson, D.,Williamson, B. Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67:4541-4559, 2024 Cited by PubMed: 38466661 DOI: 10.1021/acs.jmedchem.3c01860 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.089 Å)

Structure validation