5IPJ

Crystal structure of human Pim-1 kinase in complex with a quinazolinone-pyrrolopyrrolone inhibitor.

Summary for 5IPJ

• Entry DOI: 10.2210/pdb5ipj/pdb
• Descriptor: Serine/threonine-protein kinase pim-1, 2-(tert-butylamino)-3-methyl-8-[(6R)-6-methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrol-2-yl]quinazolin-4(3H)-one, GLYCEROL, ... (4 entities in total)
• Functional Keywords: transferase, serine/threonine protein kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Isoform 2: Cytoplasm. Isoform 1: Cell membrane: P11309
• Total number of polymer chains: 1
• Total formula weight: 33706.13

Authors

Mohr, C. (deposition date: 2016-03-09, release date: 2016-06-22, Last modification date: 2024-03-06)

• Primary citation: Pettus, L.H.,Andrews, K.L.,Booker, S.K.,Chen, J.,Cee, V.J.,Chavez, F.,Chen, Y.,Eastwood, H.,Guerrero, N.,Herberich, B.,Hickman, D.,Lanman, B.A.,Laszlo, J.,Lee, M.R.,Lipford, J.R.,Mattson, B.,Mohr, C.,Nguyen, Y.,Norman, M.H.,Powers, D.,Reed, A.B.,Rex, K.,Sastri, C.,Tamayo, N.,Wang, P.,Winston, J.T.,Wu, B.,Wu, T.,Wurz, R.P.,Xu, Y.,Zhou, Y.,Tasker, A.S.,Wang, H.L.; Discovery and Optimization of Quinazolinone-pyrrolopyrrolones as Potent and Orally Bioavailable Pan-Pim Kinase Inhibitors.; J.Med.Chem., 59:6407-6430, 2016; PubMed: 27285051; DOI: 10.1021/acs.jmedchem.6b00610

Experimental method

X-RAY DIFFRACTION (2.1 Å)