2X9E

HUMAN MPS1 IN COMPLEX WITH NMS-P715

Summary for 2X9E

Related3HMO 3HMP 3H9F 3HMN 3GFW 2ZMC 3CEK 2ZMD 3DBQ
DescriptorDUAL SPECIFICITY PROTEIN KINASE TTK, N-(2,6-DIETHYLPHENYL)-1-METHYL-8-({4-[(1-METHYLPIPERIDIN-4-YL)CARBAMOYL]-2-(TRIFLUOROMETHOXY)PHENYL}AMINO)-4,5-DIHYDRO-1H-PYRAZOLO[4,3-H]QUINAZOLINE-3-CARBOXAMIDE (3 entities in total)
Functional Keywordskinase, serine/threonine-protein kinase, transferase, tyrosine-protein kinase, mitotic checkpoint
Biological sourceHOMO SAPIENS (HUMAN)
Total number of polymer chains1
Total molecular weight36916.38
Authors
Primary citation
Colombo, R.,Caldarelli, M.,Mennecozzi, M.,Giorgini, M.L.,Sola, F.,Cappella, P.,Perrera, C.,Depaolini, S.R.,Rusconi, L.,Cucchi, U.,Avanzi, N.,Bertrand, J.A.,Bossi, R.T.,Pesenti, E.,Galvani, A.,Isacchi, A.,Colotta, F.,Donati, D.,Moll, J.
Targeting the Mitotic Checkpoint for Cancer Therapy with Nms-P715, an Inhibitor of Mps1 Kinase.
Cancer Res., 70:10255-, 2010
PubMed: 21159646 (PDB entries with the same primary citation)
DOI: 10.1158/0008-5472.CAN-10-2101
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (3.1 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.20236 3.2% 9.4%0MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution