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Structure paper

Title3-Substituted 1-Naphthamidomethyl-C-galactosyls Interact with Two Unique Sub-sites for High-Affinity and High-Selectivity Inhibition of Galectin-3.
Journal, issue, pagesMolecules, Vol. 24, Year 2019
Publish dateNov 13, 2019 (structure data deposition date)
AuthorsDahlqvist, A. / Mandal, S. / Peterson, K. / Hakansson, M. / Logan, D.T. / Zetterberg, F.R. / Leffler, H. / Nilsson, U.J.
External linksMolecules / PubMed:31842451
MethodsX-ray diffraction
Resolution1.4 - 1.5 Å
Structure data

PDB-6tf6:
Human galectin-3c in complex with a galactose derivative
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-6tf7:
Human galectin-3c in complex with a galactose derivative
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

Chemicals

ChemComp-CL:
Unknown entry

ChemComp-N62:
~{N}-[[(2~{S},3~{S},4~{R},5~{S},6~{R})-4-[[5,6-bis(fluoranyl)-2-oxidanylidene-chromen-3-yl]methoxy]-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]methyl]-4-fluoranyl-naphthalene-1-carboxamide

ChemComp-HOH:
WATER

ChemComp-SCN:
THIOCYANATE ION

ChemComp-N6B:
4-fluoranyl-~{N}-[[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-3,5-bis(oxidanyl)-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxan-2-yl]methyl]naphthalene-1-carboxamide

Source
  • homo sapiens (human)
KeywordsSUGAR BINDING PROTEIN

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