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TitleCarbonic anhydrase inhibitors: X-ray and molecular modeling study for the interaction of a fluorescent antitumor sulfonamide with isozyme II and IX.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 128, Page 8329-8335, Year 2006
Publish dateNov 14, 2005 (structure data deposition date)
AuthorsAlterio, V. / Vitale, R.M. / Monti, S.M. / Pedone, C. / Scozzafava, A. / Cecchi, A. / De Simone, G. / Supuran, C.T.
External linksJ. Am. Chem. Soc. / PubMed:16787097
MethodsX-ray diffraction
Resolution1.71 Å
Structure data

PDB-2f14:
Tne Crystal Structure of the Human Carbonic Anhydrase II in Complex with a Fluorescent Inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.71 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-HGB:
4-(HYDROXYMERCURY)BENZOIC ACID

ChemComp-FL1:
5-{[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONOTHIOYL]AMINO}-2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)BENZOIC ACID

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsLYASE / CARBONIC ANHYDRASE II

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