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Structure paper

TitleTetrazole Is a Novel Zinc Binder Chemotype for Carbonic Anhydrase Inhibition.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 16, Page 163-166, Year 2025
Publish dateSep 19, 2024 (structure data deposition date)
AuthorsGiovannuzzi, S. / Angeli, A. / Begines, P. / Ferraroni, M. / Nocentini, A. / Supuran, C.T.
External linksAcs Med. Chem. Lett. / PubMed:39811134
MethodsX-ray diffraction
Resolution1.35 - 1.7 Å
Structure data

PDB-9gu7:
Human carbonic anhydrase II complexed with N-phenyl-2-(1H-tetrazol-5-yl)acetamide
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-9gum:
Human carbonic anhydrase II complexed with N-phenethyl-2-(1H-tetrazol-5-yl)acetamide
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-9guo:
Human carbonic anhydrase II complexed with 2-(1H-tetrazol-5-yl)acetic acid
Method: X-RAY DIFFRACTION / Resolution: 1.65 Å

Chemicals

PDB-1iox:
NMR Structure of human Betacellulin-2

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-ZN:
Unknown entry

ChemComp-HOH:
WATER

PDB-1io3:
CRYSTAL STRUCTURE OF FERRICYTOCHROME C2 FROM RHODOPSEUDOMONAS VIRIDIS

ChemComp-BXH:
ethyl 2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanoate

Source
  • homo sapiens (human)
KeywordsLYASE / tetrazole / carbonic anhydrase II / inhibitor / metalloenzyme

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