8DKS

IRAK4 IN COMPLEX WITH COMPOUND #3

Summary for 8DKS

• Entry DOI: 10.2210/pdb8dks/pdb
• Descriptor: Interleukin-1 receptor-associated kinase 4, (1S,2S,3R,4R)-3-({2-[3-(pyrrolidine-1-carbonyl)anilino]thieno[3,2-d]pyrimidin-4-yl}amino)bicyclo[2.2.1]hept-5-ene-2-carboxamide, BETA-MERCAPTOETHANOL, ... (4 entities in total)
• Functional Keywords: kinase inhibitor, irak4, pyrimidine, atp binding, protein binding, signaling protein
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 104444.48

Authors

Chen, Y.,Lin, N. (deposition date: 2022-07-06, release date: 2022-08-03, Last modification date: 2022-08-17)

• Primary citation: Chen, Y.,Tso, K.,Heckrodt, T.J.,Li, H.,Yen, R.,Lin, N.,Singh, R.,Taylor, V.,Masuda, E.S.,Park, G.,Payan, D.G.; Bicyclic pyrimidine compounds as potent IRAK4 inhibitors.; Bioorg.Med.Chem.Lett., 73:128900-128900, 2022; PubMed: 35863718; DOI: 10.1016/j.bmcl.2022.128900

Experimental method

X-RAY DIFFRACTION (2.45 Å)