5JGA

Crystal structure of human TAK1/TAB1 fusion protein in complex with ligand 11c

Summary for 5JGA

• Entry DOI: 10.2210/pdb5jga/pdb
• Related: 5JGB 5JGD
• Descriptor: TAK1 kinase - TAB1 chimera fusion protein, N-[5-(4-methylpiperazine-1-carbonyl)[1,1'-biphenyl]-2-yl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidine-7-carboxamide (3 entities in total)
• Functional Keywords: transferase-transferase inhibitor complex, tak1-tab1 kinase, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human); More
• Total number of polymer chains: 1
• Total formula weight: 36004.50

Authors

Irie, M.,Nakamura, M.,Fukami, T.A.,Matsuura, T.,Morishima, K. (deposition date: 2016-04-19, release date: 2016-07-27, Last modification date: 2023-11-08)

• Primary citation: Muraoka, T.,Ide, M.,Morikami, K.,Irie, M.,Nakamura, M.,Miura, T.,Kamikawa, T.,Nishihara, M.,Kashiwagi, H.; Discovery of a potent and highly selective transforming growth factor beta receptor-associated kinase 1 (TAK1) inhibitor by structure based drug design (SBDD); Bioorg.Med.Chem., 24:4206-4217, 2016; PubMed: 27448772; DOI: 10.1016/j.bmc.2016.07.006

Experimental method

X-RAY DIFFRACTION (2 Å)