3DAJ
Crystal structure of Aurora A complexed with an inhibitor discovered through site-directed dynamic tethering
Summary for 3DAJ
| Entry DOI | 10.2210/pdb3daj/pdb |
| Descriptor | serine/threonine kinase 6, N-butyl-3-{[6-(9H-purin-6-ylamino)hexanoyl]amino}benzamide (3 entities in total) |
| Functional Keywords | protein-small molecule inhibitor complex, kinase, transferase |
| Biological source | Mus musculus (mouse) |
| Total number of polymer chains | 1 |
| Total formula weight | 31986.67 |
| Authors | He, M.M. (deposition date: 2008-05-29, release date: 2008-07-08, Last modification date: 2024-02-21) |
| Primary citation | Cancilla, M.T.,He, M.M.,Viswanathan, N.,Simmons, R.L.,Taylor, M.,Fung, A.D.,Cao, K.,Erlanson, D.A. Discovery of an Aurora kinase inhibitor through site-specific dynamic combinatorial chemistry. Bioorg.Med.Chem.Lett., 18:3978-3981, 2008 Cited by PubMed: 18579375DOI: 10.1016/j.bmcl.2008.06.011 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2 Å) |
Structure validation
Download full validation report
