4GEB

Kynurenine Aminotransferase II Inhibitors

Summary for 4GEB

Entry DOI	10.2210/pdb4geb/pdb
Related	4GDY 4GE4 4GE7 4GE9
Descriptor	Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial, (5-hydroxy-4-{[(7-hydroxy-6-oxo-2-phenyl-6,7-dihydro-2H-pyrazolo[3,4-b]pyridin-5-yl)amino]methyl}-6-methylpyridin-3-yl)methyl dihydrogen phosphate, SULFATE ION, ... (4 entities in total)
Functional Keywords	aminotransferase, irreversible inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Mitochondrion (Potential): Q8N5Z0
Total number of polymer chains	2
Total formula weight	99231.15
Authors	Pandit, J. (deposition date: 2012-08-01, release date: 2013-03-20, Last modification date: 2023-09-13)
Primary citation	Dounay, A.B.,Anderson, M.,Bechle, B.M.,Evrard, E.,Gan, X.,Kim, J.Y.,McAllister, L.A.,Pandit, J.,Rong, S.,Salafia, M.A.,Tuttle, J.B.,Zawadzke, L.E.,Verhoest, P.R. PF-04859989 as a template for structure-based drug design: identification of new pyrazole series of irreversible KAT II inhibitors with improved lipophilic efficiency. Bioorg.Med.Chem.Lett., 23:1961-1966, 2013 Cited by PubMed: 23466229 DOI: 10.1016/j.bmcl.2013.02.039 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.15 Å)

Structure validation