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Structure paper

TitleN-Acetyl glycals are tight-binding and environmentally insensitive inhibitors of hexosaminidases.
Journal, issue, pagesChem. Commun. (Camb. ), Vol. 52, Page 7943-7946, Year 2016
Publish dateDec 15, 2015 (structure data deposition date)
AuthorsSantana, A.G. / Vadlamani, G. / Mark, B.L. / Withers, S.G.
External linksChem. Commun. (Camb. ) / PubMed:27253678
MethodsX-ray diffraction
Resolution2 - 2.45 Å
Structure data

PDB-5fcz:
Streptomyces plicatus N-acetyl-beta-hexosaminidase in complex with Thio-NAglucal (TNX)
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

PDB-5fd0:
Streptomyces plicatus N-acetyl-beta-hexosaminidase in complex with NAGlucal
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-TNX:
1,5-anhydro-2-deoxy-2-(ethanethioylamino)-D-arabino-hex-1-enitol

ChemComp-SO4:
SULFATE ION

ChemComp-GOL:
GLYCEROL

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

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

Source
  • streptomyces plicatus (bacteria)
KeywordsHYDROLASE / Family 20 glycoside hydrolase / SpHex / GH20 / Thio-NAG-glucal / hexosaminidase / glycosidase inhibitor / NAG-glucal

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