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Structure paper

TitleSelenols: a new class of carbonic anhydrase inhibitors.
Journal, issue, pagesChem. Commun. (Camb. ), Vol. 55, Page 648-651, Year 2019
Publish dateOct 15, 2018 (structure data deposition date)
AuthorsAngeli, A. / Tanini, D. / Nocentini, A. / Capperucci, A. / Ferraroni, M. / Gratteri, P. / Supuran, C.T.
External linksChem. Commun. (Camb. ) / PubMed:30560259
MethodsX-ray diffraction
Resolution1.44 - 2.77 Å
Structure data

PDB-6hwz:
Selenols: a new class of Carbonic Anhydrase inhibitors
Method: X-RAY DIFFRACTION / Resolution: 1.64 Å

PDB-6hx5:
Selenols: a new class of Carbonic Anhydrase inhibitors
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-6swm:
selenol bound carbonic anhydrase I
Method: X-RAY DIFFRACTION / Resolution: 2.77 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-GXE:
benzeneselenol

ChemComp-HOH:
WATER

ChemComp-LVW:
(2~{R})-1-prop-2-enoxy-3-selanyl-propan-2-ol

Source
  • homo sapiens (human)
KeywordsLYASE / PROTEIN BINDING / inhibitor / carbonic anhydrase / selenol

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