5CUQ

Identification and characterization of novel broad spectrum inhibitors of the flavivirus methyltransferase

Summary for 5CUQ

DescriptorNonstructural protein NS5, N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA (3 entities in total)
Functional Keywordsinhibitor, complex, dengue virus, methyltransferase, viral protein-inhibitor complex, viral protein/inhibitor
Biological sourceDengue virus 3
Total number of polymer chains2
Total molecular weight60884.02
Authors
Brecher, B.,Chen, H.,Li, Z.,Banavali, N.K.,Jones, S.A.,Zhang, J.,Kramer, L.D.,Li, H.M. (deposition date: 2015-07-24, release date: 2016-02-03, Last modification date: 2017-09-27)
Primary citation
Brecher, M.,Chen, H.,Li, Z.,Banavali, N.K.,Jones, S.A.,Zhang, J.,Kramer, L.D.,Li, H.
Identification and Characterization of Novel Broad-Spectrum Inhibitors of the Flavivirus Methyltransferase.
Acs Infect Dis., 1:340-349, 2015
PubMed: 26726314 (PDB entries with the same primary citation)
DOI: 10.1021/acsinfecdis.5b00070
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.696 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.219700.2%1.2%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 5cuq
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Molmil generated image of 5cuq
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Molmil generated image of 5cuq
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More Biological unit images

Molmil generated image of 5cuq
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Molmil generated image of 5cuq
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Molmil generated image of 5cuq
rotated about y axis by 90°
(*)In the case of coarse surface representation, the asymmetric unit is shown as red ribbon representation.
Coordinate files for Biological unit (5cuq.pdb2.gz [48.37 KB])
Coordinate files for Biological unit (5cuq.pdb1.gz [48.67 KB])