Structure of Human ROS1 Kinase Domain in Complex with Crizotinib

Summary for 3ZBF

DescriptorPROTO-ONCOGENE TYROSINE-PROTEIN KINASE ROS, 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine (3 entities in total)
Functional Keywordstransferase, tyrosine kinase
Biological sourceHOMO SAPIENS (HUMAN)
Total number of polymer chains1
Total molecular weight37464.82
McTigue, M.,Deng, Y.,Liu, W.,Brooun, A.,Stewart, A. (deposition date: 2012-11-08, release date: 2013-06-12, Last modification date: 2019-05-08)
Primary citation
Awad, M.M.,Katayama, R.,Mctigue, M.,Liu, W.,Deng, Y.,Brooun, A.,Friboulet, L.,Huang, D.,Falk, M.D.,Timofeevski, S.,Wilner, K.D.,Lockerman, E.L.,Khan, T.M.,Mahmood, S.,Gainor, J.F.,Digumarthy, S.R.,Stone, J.R.,Mino-Kenudson, M.,Christensen, J.G.,Iafrate, J.,Engelman, J.A.,Shaw, A.T.
Acquired Resistance to Crizotinib from a Mutation in Cd74-Ros1
N.Engl.J.Med., 368:2395-, 2013
PubMed: 23724914 (PDB entries with the same primary citation)
DOI: 10.1056/NEJMOA1215530
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.27527 1.1% 8.0% 3.2%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

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