3DJ6

Crystal structure of the mouse Aurora-A catalytic domain (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with Compound 823.

Summary for 3DJ6

• Entry DOI: 10.2210/pdb3dj6/pdb
• Related: 2c6d 3D2I 3D2K 3DJ5 3DJ7 3d14 3d15
• Descriptor: serine/threonine kinase 6, 4-methoxy-N-phenyl-3-({3-[(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)sulfanyl]propanoyl}amino)benzamide (3 entities in total)
• Functional Keywords: aurora a, small-molecule inhibitor, fragment-based drug discovery, kinase, transferase
• Biological source: Mus musculus (mouse)
• Total number of polymer chains: 1
• Total formula weight: 32009.72

Authors

Elling, R.A.,Erlanson, D.A.,Yang, W.,Tangonan, B.T.,Hansen, S.K.,Romanowski, M.J. (deposition date: 2008-06-22, release date: 2009-05-05, Last modification date: 2023-08-30)

• Primary citation: Elling, R.A.,Erlanson, D.A.,Yang, W.,Tangonan, B.T.,Hansen, S.K.,Romanowski, M.J.; New fragment-based drug discovery; To be Published,

Experimental method

X-RAY DIFFRACTION (1.7 Å)