6DGT

Selective PI3K beta inhibitor bound to PI3K delta

Summary for 6DGT

Entry DOI	10.2210/pdb6dgt/pdb
Descriptor	Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, 4-[1-(5,8-difluoroquinolin-4-yl)-2-methyl-4-(4H-1,2,4-triazol-3-yl)-1H-benzimidazol-6-yl]-3-fluoropyridin-2-amine (3 entities in total)
Functional Keywords	pi3k delta, p110, inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Mus musculus (Mouse)
Total number of polymer chains	1
Total formula weight	108110.90
Authors	Somoza, J.,Villasenor, A.,McGrath, M. (deposition date: 2018-05-18, release date: 2018-08-01, Last modification date: 2024-03-13)
Primary citation	Chandrasekhar, J.,Dick, R.,Van Veldhuizen, J.,Koditek, D.,Lepist, E.I.,McGrath, M.E.,Patel, L.,Phillips, G.,Sedillo, K.,Somoza, J.R.,Therrien, J.,Till, N.A.,Treiberg, J.,Villasenor, A.G.,Zherebina, Y.,Perreault, S. Atropisomerism by Design: Discovery of a Selective and Stable Phosphoinositide 3-Kinase (PI3K) beta Inhibitor. J. Med. Chem., 61:6858-6868, 2018 Cited by PubMed: 30015489 DOI: 10.1021/acs.jmedchem.8b00797 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.601 Å)

Structure validation