6OCU

HUMAN PI3KDELTA IN COMPLEX WITH COMPOUND 29

Summary for 6OCU

• Entry DOI: 10.2210/pdb6ocu/pdb
• Descriptor: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Phosphatidylinositol 3-kinase regulatory subunit alpha, 5-{(3R)-3-methyl-4-[(1R,2R)-2-methylcyclopropane-1-carbonyl]piperazin-1-yl}-3-(1-methyl-1H-pyrazol-4-yl)pyrazine-2-carbonitrile (3 entities in total)
• Functional Keywords: pi3kdelta kinase, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human); More
• Total number of polymer chains: 2
• Total formula weight: 142966.46

Authors

Lesburg, C.A.,Augustin, M.A. (deposition date: 2019-03-25, release date: 2019-12-11, Last modification date: 2024-03-13)

• Primary citation: Zhou, H.,McGowan, M.A.,Lipford, K.,Christopher, M.,Fradera, X.,Witter, D.,Lesburg, C.A.,Li, C.,Methot, J.L.,Lampe, J.,Achab, A.,Shaffer, L.,Goldenblatt, P.,Shah, S.,Bass, A.,Schroeder, G.,Chen, D.,Zeng, H.,Augustin, M.A.,Katz, J.D.; Discovery and optimization of heteroaryl piperazines as potent and selective PI3K delta inhibitors.; Bioorg.Med.Chem.Lett., 30:126715-126715, 2020; PubMed: 31757666; DOI: 10.1016/j.bmcl.2019.126715

Experimental method

X-RAY DIFFRACTION (2.77 Å)