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Structure paper

TitleInterplay of halogen bonding and solvation in protein-ligand binding.
Journal, issue, pagesIscience, Vol. 27, Page 109636-109636, Year 2024
Publish dateJun 13, 2019 (structure data deposition date)
AuthorsVerteramo, M.L. / Ignjatovic, M.M. / Kumar, R. / Wernersson, S. / Ekberg, V. / Wallerstein, J. / Carlstrom, G. / Chadimova, V. / Leffler, H. / Zetterberg, F. ...Verteramo, M.L. / Ignjatovic, M.M. / Kumar, R. / Wernersson, S. / Ekberg, V. / Wallerstein, J. / Carlstrom, G. / Chadimova, V. / Leffler, H. / Zetterberg, F. / Logan, D.T. / Ryde, U. / Akke, M. / Nilsson, U.J.
External linksIscience / PubMed:38633000
MethodsX-ray diffraction
Resolution1.095 Å
Structure data

PDB-6rzi:
Galectin-3C in complex with trifluoroaryltriazole monothiogalactoside derivative:1(Hydrogen)
Method: X-RAY DIFFRACTION / Resolution: 1.095 Å

Chemicals

ChemComp-KP8:
(2~{R},3~{R},4~{S},5~{R},6~{R})-2-(hydroxymethyl)-6-phenylsulfanyl-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxane-3,5-diol

ChemComp-SCN:
THIOCYANATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSUGAR BINDING PROTEIN / LECTIN / CARBOHYDRATE-BINDING PROTEIN / GALACTOSE-SPECIFIC LECTIN 3 / GALACTOSIDE-BINDING PROTEIN / GALBP / IGE-6 BINDING PROTEIN / L-31 / LAMININ-BINDING PROTEIN / LECTIN L-29 / MAC-2

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