4DK5

Crystal structure of human PI3K-gamma in complex with a pyridyl-triazine inhibitor

Summary for 4DK5

• Entry DOI: 10.2210/pdb4dk5/pdb
• Descriptor: Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION, 4-(2-[(6-methoxypyridin-3-yl)amino]-5-{[4-(methylsulfonyl)piperazin-1-yl]methyl}pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine, ... (4 entities in total)
• Functional Keywords: phosphotransferase, cancer, p85-alpha, p85-beta, ras, transferase-inhibitor complex, transferase/inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm: P48736
• Total number of polymer chains: 1
• Total formula weight: 110540.75

Authors

Whittington, D.A.,Tang, J.,Yakowec, P. (deposition date: 2012-02-03, release date: 2012-05-16, Last modification date: 2023-09-13)

• Primary citation: Smith, A.L.,D'Angelo, N.D.,Bo, Y.Y.,Booker, S.K.,Cee, V.J.,Herberich, B.,Hong, F.T.,Jackson, C.L.,Lanman, B.A.,Liu, L.,Nishimura, N.,Pettus, L.H.,Reed, A.B.,Tadesse, S.,Tamayo, N.A.,Wurz, R.P.,Yang, K.,Andrews, K.L.,Whittington, D.A.,McCarter, J.D.,Miguel, T.S.,Zalameda, L.,Jiang, J.,Subramanian, R.,Mullady, E.L.,Caenepeel, S.,Freeman, D.J.,Wang, L.,Zhang, N.,Wu, T.,Hughes, P.E.,Norman, M.H.; Structure-based design of a novel series of potent, selective inhibitors of the class I phosphatidylinositol 3-kinases.; J.Med.Chem., 55:5188-5219, 2012; PubMed: 22548365; DOI: 10.1021/jm300184s

Experimental method

X-RAY DIFFRACTION (2.95 Å)