4AOF

Selective small molecule inhibitor discovered by chemoproteomic assay platform reveals regulation of Th17 cell differentiation by PI3Kgamma

Summary for 4AOF

Entry DOI	10.2210/pdb4aof/pdb
Related	1E8Y 1E8Z 1HE8 2A4Z 2A5U 2CHW 2CHX 2CHZ 2V4L 3ZVV 3ZW3 4ANU 4ANV 4ANW 4ANX
Descriptor	PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CATALYTIC SUBUNIT GAMMA ISOFORM, N-[6-(5-methylsulfonylpyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanamide (3 entities in total)
Functional Keywords	transferase
Biological source	HOMO SAPIENS (HUMAN)
Cellular location	Cytoplasm: P48736
Total number of polymer chains	1
Total formula weight	110229.55
Authors	Bergamini, G.,Bell, K.,Shimamura, S.,Werner, T.,Cansfield, A.,Muller, K.,Perrin, J.,Rau, C.,Ellard, K.,Hopf, C.,Doce, C.,Leggate, D.,Mangano, R.,Mathieson, T.,OMahony, A.,Plavec, I.,Rharbaoui, F.,Reinhard, F.,Savitski, M.M.,Ramsden, N.,Hirsch, E.,Drewes, G.,Rausch, O.,Bantscheff, M.,Neubauer, G. (deposition date: 2012-03-26, release date: 2012-05-09, Last modification date: 2023-12-20)
Primary citation	Bergamini, G.,Bell, K.,Shimamura, S.,Werner, T.,Cansfield, A.,Muller, K.,Perrin, J.,Rau, C.,Ellard, K.,Hopf, C.,Doce, C.,Leggate, D.,Mangano, R.,Mathieson, T.,O'Mahony, A.,Plavec, I.,Rharbaoui, F.,Reinhard, F.,Savitski, M.M.,Ramsden, N.,Hirsch, E.,Drewes, G.,Rausch, O.,Bantscheff, M.,Neubauer, G. A Selective Inhibitor Reveals Pi3Kgamma Dependence of T(H)17 Cell Differentiation. Nat.Chem.Biol., 8:576-, 2012 Cited by PubMed: 22544264 DOI: 10.1038/NCHEMBIO.957 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (3.3 Å)

Structure validation