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Structure paper

TitleThe identification of novel acid isostere based inhibitors of the VPS10P family sorting receptor Sortilin.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 27, Page 2629-2633, Year 2017
Publish dateDec 23, 2016 (structure data deposition date)
AuthorsAndersen, J.L. / Lindberg, S. / Langgard, M. / Maltas, P.J. / Ronn, L.C.B. / Bundgaard, C. / Strandbygaard, D. / Thirup, S. / Watson, S.P.
External linksBioorg. Med. Chem. Lett. / PubMed:28462834
MethodsX-ray diffraction
Resolution2 - 2.5 Å
Structure data

PDB-5mrh:
Crystal structure of the Vps10p domain of human sortilin/NTS3 in complex with Triazolone 1
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-5mri:
Crystal structure of the Vps10p domain of human sortilin/NTS3 in complex with Triazolone 18
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-Q9Z:
3-(3-methylbutyl)-4~{H}-1,2,3-triazol-5-one

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-HOH:
WATER

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-Q9Y:
~{N}-methyl-3-(3-methylbutyl)-5-oxidanyl-1,2,3-triazole-4-carboxamide

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN / Receptor / Vsp10p / Sortilin / Vps10p

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