6XRL

Crystal structure of human PI3K-gamma in complex with inhibitor IPI-549

Summary for 6XRL

• Entry DOI: 10.2210/pdb6xrl/pdb
• Descriptor: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, 2-amino-N-[(1S)-1-{8-[(1-methyl-1H-pyrazol-4-yl)ethynyl]-1-oxo-2-phenyl-1,2-dihydroisoquinolin-3-yl}ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide, SULFATE ION, ... (4 entities in total)
• Functional Keywords: phosphoinositide 3-kinase gamma, inhibitor, immunosuppression, cancer, proteros, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 109466.57

Authors

Walker, N.P.,Jeffrey, J.L. (deposition date: 2020-07-13, release date: 2020-09-16, Last modification date: 2024-03-06)

• Primary citation: Drew, S.L.,Thomas-Tran, R.,Beatty, J.W.,Fournier, J.,Lawson, K.V.,Miles, D.H.,Mata, G.,Sharif, E.U.,Yan, X.,Mailyan, A.K.,Ginn, E.,Chen, J.,Wong, K.,Soni, D.,Dhanota, P.,Chen, P.Y.,Shaqfeh, S.G.,Meleza, C.,Pham, A.T.,Chen, A.,Zhao, X.,Banuelos, J.,Jin, L.,Schindler, U.,Walters, M.J.,Young, S.W.,Walker, N.P.,Leleti, M.R.,Powers, J.P.,Jeffrey, J.L.; Discovery of Potent and Selective PI3K gamma Inhibitors.; J.Med.Chem., 63:11235-11257, 2020; PubMed: 32865410; DOI: 10.1021/acs.jmedchem.0c01203

Experimental method

X-RAY DIFFRACTION (2.99 Å)