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3VQU

CRYSTAL STRUCTURE OF HUMAN MPS1 CATALYTIC DOMAIN IN COMPLEX WITH 4-[(4-amino-5-cyano-6-ethoxypyridin-2- yl)amino]benzamide

Summary for 3VQU
Entry DOI10.2210/pdb3vqu/pdb
DescriptorDual specificity protein kinase TTK, IODIDE ION, 4-[(4-amino-5-cyano-6-ethoxypyridin-2-yl)amino]benzamide, ... (4 entities in total)
Functional Keywordskinase, serine/threonine-protein kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological sourceHomo sapiens (human)
Total number of polymer chains1
Total formula weight38039.71
Authors
Primary citationKusakabe, K.,Ide, N.,Daigo, Y.,Itoh, T.,Higashino, K.,Okano, Y.,Tadano, G.,Tachibana, Y.,Sato, Y.,Inoue, M.,Wada, T.,Iguchi, M.,Kanazawa, T.,Ishioka, Y.,Dohi, K.,Tagashira, S.,Kido, Y.,Sakamoto, S.,Yasuo, K.,Maeda, M.,Yamamoto, T.,Higaki, M.,Endoh, T.,Ueda, K.,Shiota, T.,Murai, H.,Nakamura, Y.
Diaminopyridine-based potent and selective mps1 kinase inhibitors binding to an unusual flipped-Peptide conformation.
Acs Med.Chem.Lett., 3:560-564, 2012
Cited by
PubMed: 24900510
DOI: 10.1021/ml3000879
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.4 Å)
Structure validation

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