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TitleEnhancing Potency and Selectivity of a DC-SIGN Glycomimetic Ligand by Fragment-Based Design: Structural Basis.
Journal, issue, pagesChemistry, Vol. 25, Page 14659-14668, Year 2019
Publish dateMay 9, 2018 (structure data deposition date)
AuthorsMedve, L. / Achilli, S. / Guzman-Caldentey, J. / Thepaut, M. / Senaldi, L. / Le Roy, A. / Sattin, S. / Ebel, C. / Vives, C. / Martin-Santamaria, S. ...Medve, L. / Achilli, S. / Guzman-Caldentey, J. / Thepaut, M. / Senaldi, L. / Le Roy, A. / Sattin, S. / Ebel, C. / Vives, C. / Martin-Santamaria, S. / Bernardi, A. / Fieschi, F.
External linksChemistry / PubMed:31469191
MethodsX-ray diffraction
Resolution2.1 Å
Structure data

PDB-6ghv:
Structure of a DC-SIGN CRD in complex with high affinity glycomimetic.
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-EZ8:
[1-[(2~{S},3~{S},4~{R},5~{S},6~{R})-2-[(1~{S},2~{S},4~{S},5~{S})-2-(2-chloroethyloxy)-4,5-bis[[4-(hydroxymethyl)phenyl]methylcarbamoyl]cyclohexyl]oxy-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]-1,2,3-triazol-4-yl]methylazanium

ChemComp-CA:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSUGAR BINDING PROTEIN / DC-SIGN / Inhibitor

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