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Structure paper

TitleSBDD of Carbonic Anhydrase II Inhibitors
Journal, issue, pagesTo Be Published
Publish dateJan 17, 2024 (structure data deposition date)
AuthorsIsmail, M.M.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.409 - 1.5 Å
Structure data

PDB-8vq5:
hCA-II-Bivalent compound bound complex EthylUreadibenzensulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-8vq6:
hCA-II-4-(2-Aminoethyl)benzenesulfonamide-complex. Two molecules of inhibitor bound to active site and secondary binding pocket
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-8vq7:
hCA-II-apo structure
Method: X-RAY DIFFRACTION / Resolution: 1.409 Å

Chemicals

ChemComp-ZN:
Unknown entry


PDB Unreleased entry

PDB-1adh: Unknown entry

ChemComp-ZYX:
4-(2-AMINOETHYL)BENZENESULFONAMIDE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsLYASE/INHIBITOR / Carbonic Anhydrase II / human Carbonic anhydrase II / carbon anhydrase / Two pockets bound / binding pocket / binding pockets / active site / small molecule / bivalent / urea / complex / protein ligand complex / protein inhibition / inhibitor / binder / nano molar binder / nano molar inhibitor / PROTEIN BINDING / LYASE-INHIBITOR complex / 4-(2-Aminoethyl)benzenesulfonamide / secondary binding site / ZYX

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