4I5C

The Jak1 kinase domain in complex with inhibitor

Summary for 4I5C

• Entry DOI: 10.2210/pdb4i5c/pdb
• Descriptor: Tyrosine-protein kinase JAK1, 3-oxo-3-[(3R)-3-(pyrrolo[2,3-b][1,2,3]triazolo[4,5-d]pyridin-1(6H)-yl)piperidin-1-yl]propanenitrile, 1,2-ETHANEDIOL, ... (4 entities in total)
• Functional Keywords: kinase, transferase
• Biological source: Homo sapiens (human)
• Cellular location: Endomembrane system; Peripheral membrane protein: P23458
• Total number of polymer chains: 2
• Total formula weight: 70360.11

Authors

Fong, R.,Lupardus, P.J. (deposition date: 2012-11-28, release date: 2013-05-22, Last modification date: 2023-12-06)

• Primary citation: Hurley, C.A.,Blair, W.S.,Bull, R.J.,Chang, C.,Crackett, P.H.,Deshmukh, G.,Dyke, H.J.,Fong, R.,Ghilardi, N.,Gibbons, P.,Hewitt, P.R.,Johnson, A.,Johnson, T.,Kenny, J.R.,Kohli, P.B.,Kulagowski, J.J.,Liimatta, M.,Lupardus, P.J.,Maxey, R.J.,Mendonca, R.,Narukulla, R.,Pulk, R.,Ubhayakar, S.,van Abbema, A.,Ward, S.I.,Waszkowycz, B.,Zak, M.; Novel triazolo-pyrrolopyridines as inhibitors of Janus kinase 1.; Bioorg.Med.Chem.Lett., 23:3592-3598, 2013; PubMed: 23642482; DOI: 10.1016/j.bmcl.2013.04.018

Experimental method

X-RAY DIFFRACTION (2.1 Å)