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TitleEffect of incorporating a thiophene tail in the scaffold of acetazolamide on the inhibition of human carbonic anhydrase isoforms I, II, IX and XII.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 23, Page 5646-5649, Year 2013
Publish dateJan 24, 2013 (structure data deposition date)
AuthorsBiswas, S. / McKenna, R. / Supuran, C.T.
External linksBioorg. Med. Chem. Lett. / PubMed:23993330
MethodsX-ray diffraction
Resolution1.598 Å
Structure data

PDB-4iwz:
structure of hCAII in complex with an acetazolamide derivative
Method: X-RAY DIFFRACTION / Resolution: 1.598 Å

Chemicals

ChemComp-1GO:
N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)-2-(thiophen-2-yl)acetamide

ChemComp-ZN:
Unknown entry

ChemComp-GOL:
GLYCEROL

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsLYASE/LYASE INHIBITOR / alpha beta fold / reversible hydration of carbon di oxide to bicarbonate and proton / LYASE-LYASE INHIBITOR complex

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