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Structure paper

TitleOut of the active site binding pocket for carbonic anhydrase inhibitors.
Journal, issue, pagesChem. Commun. (Camb. ), Vol. 51, Page 302-305, Year 2014
Publish dateJul 23, 2014 (structure data deposition date)
AuthorsD'Ambrosio, K. / Carradori, S. / Monti, S.M. / Buonanno, M. / Secci, D. / Vullo, D. / Supuran, C.T. / De Simone, G.
External linksChem. Commun. (Camb. ) / PubMed:25407638
MethodsX-ray diffraction
Resolution1.5 Å
Structure data

PDB-4qy3:
THE CRYSTAL STRUCTURE OF THE COMPLEX of HCAII WITH AN ORTHO-SUBSTITUTED BENZOIC ACID
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-3G1:
2-[(S)-benzylsulfinyl]benzoic acid

ChemComp-HGB:
4-(HYDROXYMERCURY)BENZOIC ACID

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsLyase/Lyase inhibitor / CARBONIC ANHYDRASE II / LYASE / Lyase-Lyase inhibitor complex

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