3QAQ

Crystal structure of PI3K-gamma in complex with triazine-benzimidazole 1

Summary for 3QAQ

• Entry DOI: 10.2210/pdb3qaq/pdb
• Related: 3QAR
• Descriptor: Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION, [(4-{2-[(3-hydroxyphenyl)amino]-1H-benzimidazol-1-yl}-1,3,5-triazin-2-yl)amino]acetonitrile, ... (4 entities in total)
• Functional Keywords: inhibitor, p110, kinase, transferase, atp binding, p84, p101, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 1
• Total formula weight: 110470.60

Authors

Whittington, D.A.,Tang, J.,Yakowec, P. (deposition date: 2011-01-11, release date: 2011-03-30, Last modification date: 2023-09-13)

• Primary citation: Peterson, E.A.,Andrews, P.S.,Be, X.,Boezio, A.A.,Bush, T.L.,Cheng, A.C.,Coats, J.R.,Colletti, A.E.,Copeland, K.W.,Dupont, M.,Graceffa, R.,Grubinska, B.,Harmange, J.C.,Kim, J.L.,Mullady, E.L.,Olivieri, P.,Schenkel, L.B.,Stanton, M.K.,Teffera, Y.,Whittington, D.A.,Cai, T.,La, D.S.; Discovery of triazine-benzimidazoles as selective inhibitors of mTOR.; Bioorg.Med.Chem.Lett., 21:2064-2070, 2011; PubMed: 21376583; DOI: 10.1016/j.bmcl.2011.02.007

Experimental method

X-RAY DIFFRACTION (2.9 Å)