7CHN
Crystal structure of TTK kinase domain in complex with compound 9
Summary for 7CHN
Entry DOI | 10.2210/pdb7chn/pdb |
Descriptor | Dual specificity protein kinase TTK, 4-(cyclohexylamino)-2-[[2-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (3 entities in total) |
Functional Keywords | kinase mps1 ttk structure-guided drug design, transferase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 33337.89 |
Authors | Kim, H.L.,Cho, H.Y.,Park, Y.W.,Lee, Y.H.,Son, J.B.,Ko, E.H.,Choi, H.G.,Kim, N.D. (deposition date: 2020-07-06, release date: 2021-05-12, Last modification date: 2023-11-29) |
Primary citation | Lee, Y.,Kim, H.,Kim, H.,Cho, H.Y.,Jee, J.G.,Seo, K.A.,Son, J.B.,Ko, E.,Choi, H.G.,Kim, N.D.,Kim, I. X-ray Crystal Structure-Guided Design and Optimization of 7 H -Pyrrolo[2,3- d ]pyrimidine-5-carbonitrile Scaffold as a Potent and Orally Active Monopolar Spindle 1 Inhibitor. J.Med.Chem., 64:6985-6995, 2021 Cited by PubMed: 33942608DOI: 10.1021/acs.jmedchem.1c00542 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.4 Å) |
Structure validation
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