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Structure paper

TitleSynthesis, structure and bioactivity of primary sulfamate-containing natural products.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 28, Page 3009-3013, Year 2018
Publish dateJan 23, 2018 (structure data deposition date)
AuthorsMujumdar, P. / Bua, S. / Supuran, C.T. / Peat, T.S. / Poulsen, S.A.
External linksBioorg. Med. Chem. Lett. / PubMed:29685656
MethodsX-ray diffraction
Resolution1.28 - 1.5 Å
Structure data

PDB-6c7w:
Carbonic anhydrase 2 in complex with [(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-FURANYL]METHYL SULFAMATE inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.28 Å

PDB-6c7x:
Carbonic anhydrase 2 in complex with 2-chloro-5'-O-sulfamoyladenosine
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-LMS:
[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-FURANYL]METHYL SULFAMATE

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-EO7:
2-chloro-5'-O-sulfamoyladenosine

Source
  • homo sapiens (human)
KeywordsLYASE/INHIBITOR / human carbonic anhydrase II; inhibitor; natural product / LYASE / LYASE-INHIBITOR complex

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