4GU6
FOCAL ADHESION KINASE CATALYTIC DOMAIN IN COMPLEX WITH N-{3-[(5-Cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-ylamino)- methyl]-pyridin-2-yl}-N-methyl-methanesulfonamide
Summary for 4GU6
Entry DOI | 10.2210/pdb4gu6/pdb |
Related | 3PXK |
Descriptor | Focal adhesion kinase 1, N-(3-{[(5-cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl}pyridin-2-yl)-N-methylmethanesulfonamide (3 entities in total) |
Functional Keywords | protein tyrosine kinase, atp binding, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Cell junction, focal adhesion: Q05397 |
Total number of polymer chains | 2 |
Total formula weight | 65473.44 |
Authors | Musil, D.,Heinrich, T. (deposition date: 2012-08-29, release date: 2013-09-04, Last modification date: 2023-09-13) |
Primary citation | Heinrich, T.,Seenisamy, J.,Emmanuvel, L.,Kulkarni, S.S.,Bomke, J.,Rohdich, F.,Greiner, H.,Esdar, C.,Krier, M.,Gradler, U.,Musil, D. Fragment-based discovery of new highly substituted 1H-pyrrolo[2,3-b]- and 3H-imidazolo[4,5-b]-pyridines as focal adhesion kinase inhibitors. J.Med.Chem., 56:1160-1170, 2013 Cited by PubMed: 23294348DOI: 10.1021/jm3016014 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.95 Å) |
Structure validation
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