3S4Q

P38 alpha kinase complexed with a pyrazolo-triazine based inhibitor

Summary for 3S4Q

• Entry DOI: 10.2210/pdb3s4q/pdb
• Descriptor: Mitogen-activated protein kinase 14, 3-[(6-benzoyl-5-methylpyrrolo[2,1-f][1,2,4]triazin-4-yl)amino]-N-cyclopropyl-4-methylbenzamide (3 entities in total)
• Functional Keywords: p38 map kinase, serine/threonine-protein kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm (By similarity): Q16539
• Total number of polymer chains: 1
• Total formula weight: 42530.49

Authors

Sack, J.S. (deposition date: 2011-05-20, release date: 2012-02-01, Last modification date: 2024-02-28)

• Primary citation: Dyckman, A.J.,Li, T.,Pitt, S.,Zhang, R.,Shen, D.R.,McIntyre, K.W.,Gillooly, K.M.,Shuster, D.J.,Doweyko, A.M.,Sack, J.S.,Kish, K.,Kiefer, S.E.,Newitt, J.A.,Zhang, H.,Marathe, P.H.,McKinnon, M.,Barrish, J.C.,Dodd, J.H.,Schieven, G.L.,Leftheris, K.; Discovery of pyrrolo[2,1-f][1,2,4]triazine C6-ketones as potent, orally active p38α MAP kinase inhibitors.; Bioorg.Med.Chem.Lett., 21:4633-4637, 2011; PubMed: 21705217; DOI: 10.1016/j.bmcl.2011.05.091

Experimental method

X-RAY DIFFRACTION (2.27 Å)