7QIE

Crystal Structure of Phosphatidylinositol 5-Phosphate 4-Kinase (PI5P4K2C) bound to an allosteric inhibitor

Summary for 7QIE

Entry DOI	10.2210/pdb7qie/pdb
Descriptor	Phosphatidylinositol 5-phosphate 4-kinase type-2 gamma, 5-methyl-2-(2-propan-2-ylphenyl)-~{N}-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine (3 entities in total)
Functional Keywords	allosteric binding, lipid kinase, non-atp-competitive inhibitor, phosphatidylinositol 5-phosphate, transferase
Biological source	Homo sapiens (human)
Total number of polymer chains	4
Total formula weight	169501.48
Authors	Howard, T.D.,Ogg, D.T. (deposition date: 2021-12-14, release date: 2022-05-18, Last modification date: 2024-01-31)
Primary citation	Boffey, H.K.,Rooney, T.P.C.,Willems, H.M.G.,Edwards, S.,Green, C.,Howard, T.,Ogg, D.,Romero, T.,Scott, D.E.,Winpenny, D.,Duce, J.,Skidmore, J.,Clarke, J.H.,Andrews, S.P. Development of Selective Phosphatidylinositol 5-Phosphate 4-Kinase gamma Inhibitors with a Non-ATP-competitive, Allosteric Binding Mode. J.Med.Chem., 65:3359-3370, 2022 Cited by PubMed: 35148092 DOI: 10.1021/acs.jmedchem.1c01819 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.39 Å)

Structure validation