5TBE

Human p38alpha MAP Kinase in Complex with Dibenzosuberone Compound 2

Summary for 5TBE

• Entry DOI: 10.2210/pdb5tbe/pdb
• Related: 5TCO
• Descriptor: Mitogen-activated protein kinase 14, ~{N}-[2,4-bis(fluoranyl)-5-[[9-(2-morpholin-4-ylethylcarbamoyl)-11-oxidanylidene-5,6-dihydrodibenzo[1,2-~{d}:1',2'-~{f}][7]annulen-3-yl]amino]phenyl]thiophene-2-carboxamide (3 entities in total)
• Functional Keywords: p38, kinase, inhibitor, complex, transferase
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm : Q16539
• Total number of polymer chains: 1
• Total formula weight: 41959.87

Authors

Buehrmann, M.,Rauh, D. (deposition date: 2016-09-12, release date: 2017-04-19, Last modification date: 2024-01-17)

• Primary citation: Wentsch, H.K.,Walter, N.M.,Buhrmann, M.,Mayer-Wrangowski, S.,Rauh, D.,Zaman, G.J.R.,Willemsen-Seegers, N.,Buijsman, R.C.,Henning, M.,Dauch, D.,Zender, L.,Laufer, S.; Optimized Target Residence Time: Type I1/2 Inhibitors for p38 alpha MAP Kinase with Improved Binding Kinetics through Direct Interaction with the R-Spine.; Angew. Chem. Int. Ed. Engl., 56:5363-5367, 2017; PubMed: 28397331; DOI: 10.1002/anie.201701185

Experimental method

X-RAY DIFFRACTION (2.44 Å)