4P90

Crystal structure of the kinase domain of human PAK1 in complex with compound 15

Summary for 4P90

• Entry DOI: 10.2210/pdb4p90/pdb
• Descriptor: Serine/threonine-protein kinase PAK 1, [2-chloro-5-(hydroxymethyl)phenyl]{5-[1-(piperidin-4-yl)-1H-pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl}methanone (3 entities in total)
• Functional Keywords: inhibitor, kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm: Q13153
• Total number of polymer chains: 2
• Total formula weight: 67416.30

Authors

Ferguson, A.D. (deposition date: 2014-04-01, release date: 2014-09-10, Last modification date: 2023-09-27)

• Primary citation: McCoull, W.,Hennessy, E.J.,Blades, K.,Box, M.R.,Chuaqui, C.,Dowling, J.E.,Davies, C.D.,Ferguson, A.D.,Goldberg, F.W.,Howe, N.J.,Kemmitt, P.D.,Lamont, G.M.,Madden, K.,McWhirter, C.,Varnes, J.G.,Ward, R.A.,Williams, J.D.,Yang, B.; Identification and optimisation of 7-azaindole PAK1 inhibitors with improved potency and kinase selectivity.; MEDCHEMCOMM, 2014; DOI: 10.1039/C4MD00280F

Experimental method

X-RAY DIFFRACTION (2.49 Å)