5M51

Nek2 bound to arylaminopurine compound 8

Summary for 5M51

DescriptorSerine/threonine-protein kinase Nek2, 3-[[6-(cyclohexylmethoxy)-9~{H}-purin-2-yl]amino]benzamide (3 entities in total)
Functional Keywordsprotein kinase, inhibitor, centrosome separation, transferase-inhibitor complex, transferase/inhibitor
Biological sourceHomo sapiens (Human)
Cellular locationIsoform 1: Nucleus. Isoform 2: Cytoplasm. Isoform 4: Nucleus P51955
Total number of polymer chains1
Total molecular weight33028.9
Authors
Bayliss, R.,Yeoh, S. (deposition date: 2016-10-20, release date: 2016-11-09, Last modification date: 2017-05-03)
Primary citation
Coxon, C.R.,Wong, C.,Bayliss, R.,Boxall, K.,Carr, K.H.,Fry, A.M.,Hardcastle, I.R.,Matheson, C.J.,Newell, D.R.,Sivaprakasam, M.,Thomas, H.,Turner, D.,Yeoh, S.,Wang, L.Z.,Griffin, R.J.,Golding, B.T.,Cano, C.
Structure-guided design of purine-based probes for selective Nek2 inhibition.
Oncotarget, 8:19089-19124, 2017
PubMed: 27833088 (PDB entries with the same primary citation)
DOI: 10.18632/oncotarget.13249
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.899 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.25540.4%1.9%8.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

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