6XRN

Crystal structure of human PI3K-gamma in complex with Compound 17

Summary for 6XRN

• Entry DOI: 10.2210/pdb6xrn/pdb
• Related: 6XRL 6XRM
• Descriptor: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, 2-amino-5-{2-[(1S)-1-cyclopropylethyl]-7-methyl-1-oxo-2,3-dihydro-1H-isoindol-5-yl}-N-(trans-3-hydroxycyclobutyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (2 entities in total)
• Functional Keywords: phosphoinositide 3-kinase gamma, inhibitor, ab610, 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: 109206.40

Authors

Walker, N.P.,Jeffrey, J.L. (deposition date: 2020-07-13, release date: 2021-11-03, Last modification date: 2022-02-09)

• Primary citation: Mata, G.,Miles, D.H.,Drew, S.L.,Fournier, J.,Lawson, K.V.,Mailyan, A.K.,Sharif, E.U.,Yan, X.,Beatty, J.W.,Banuelos, J.,Chen, J.,Ginn, E.,Chen, A.,Gerrick, K.Y.,Pham, A.T.,Wong, K.,Soni, D.,Dhanota, P.,Shaqfeh, S.G.,Meleza, C.,Narasappa, N.,Singh, H.,Zhao, X.,Jin, L.,Schindler, U.,Walters, M.J.,Young, S.W.,Walker, N.P.,Leleti, M.R.,Powers, J.P.,Jeffrey, J.L.; Design, Synthesis, and Structure-Activity Relationship Optimization of Pyrazolopyrimidine Amide Inhibitors of Phosphoinositide 3-Kinase gamma (PI3K gamma ).; J.Med.Chem., 65:1418-1444, 2022; PubMed: 34672584; DOI: 10.1021/acs.jmedchem.1c01153

Experimental method

X-RAY DIFFRACTION (2.96 Å)