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4C4F

Structure-based design of orally bioavailable pyrrolopyridine inhibitors of the mitotic kinase MPS1

Summary for 4C4F
Entry DOI10.2210/pdb4c4f/pdb
Related4C4E 4C4G 4C4H 4C4I 4C4J
DescriptorDUAL SPECIFICITY PROTEIN KINASE TTK, 2-(2-(2-(2-(2-(2-ETHOXYETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHANOL, N-(2-methoxyphenyl)-2-(1,3-oxazol-5-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine, ... (5 entities in total)
Functional Keywordstransferase, protein kinase, mitosis, structure-based design
Biological sourceHOMO SAPIENS (HUMAN)
Total number of polymer chains1
Total formula weight37618.91
Authors
Primary citationNaud, S.,Westwood, I.M.,Faisal, A.,Sheldrake, P.W.,Bavetsias, V.,Atrash, B.,Cheung, K.J.,Liu, M.,Hayes, A.,Schmitt, J.,Wood, A.,Choi, V.,Boxall, K.,Mak, G.,Gurden, M.,Valenti, M.,De-Haven-Brandon, A.,Henley, A.,Baker, R.,Mcandrew, C.,Matijssen, B.,Burke, R.,Hoelder, S.,Eccles, S.A.,Raynaud, F.I.,Linardopoulos, S.,Van Montfort, R.L.M.,Blagg, J.
Structure-Based Design of Orally Bioavailable 1H-Pyrrolo[3, 2-C]Pyridine Inhibitors of the Mitotic Kinase Monopolar Spindle 1 (Mps1).
J.Med.Chem., 56:10045-, 2013
Cited by
PubMed: 24256217
DOI: 10.1021/JM401395S
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.36 Å)
Structure validation

217705

数据于2024-03-27公开中

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