7QG1

IRAK4 in complex with inhibitor

Summary for 7QG1

• Entry DOI: 10.2210/pdb7qg1/pdb
• Descriptor: Interleukin-1 receptor-associated kinase 4, methyl 4-[4-[[6-(cyanomethyl)-2-[(1-methylpyrazol-4-yl)amino]-5-oxidanylidene-pyrido[4,3-d]pyrimidin-4-yl]amino]cyclohexyl]piperazine-1-carboxylate (3 entities in total)
• Functional Keywords: kinase inhibitor interleukin-1 receptor-associated kinase 4 interleukin-1 signaling, transferase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 74097.34

Authors

Xue, Y.,Aagaard, A.,Robb, G.R.,Degorce, S.L. (deposition date: 2021-12-07, release date: 2022-05-04, Last modification date: 2024-01-31)

• Primary citation: Cumming, I.A.,Degorce, S.L.,Aagaard, A.,Braybrooke, E.L.,Davies, N.L.,Diene, C.R.,Eatherton, A.J.,Felstead, H.R.,Groombridge, S.D.,Lenz, E.M.,Li, Y.,Nai, Y.,Pearson, S.,Robb, G.R.,Scott, J.S.,Steward, O.R.,Wu, C.,Xue, Y.,Zhang, L.,Zhang, Y.; Identification and optimisation of a pyrimidopyridone series of IRAK4 inhibitors.; Bioorg.Med.Chem., 63:116729-116729, 2022; PubMed: 35439688; DOI: 10.1016/j.bmc.2022.116729

Experimental method

X-RAY DIFFRACTION (2.07 Å)