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Structure paper

TitleCarbonic anhydrase inhibitors: Inhibition of human, bacterial, and archaeal isozymes with benzene-1,3-disulfonamides-Solution and crystallographic studies.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 17, Page 4201-4207, Year 2007
Publish dateApr 27, 2007 (structure data deposition date)
AuthorsAlterio, V. / De Simone, G. / Monti, S.M. / Scozzafava, A. / Supuran, C.T.
External linksBioorg. Med. Chem. Lett. / PubMed:17540563
MethodsX-ray diffraction
Resolution1.6 - 1.75 Å
Structure data

PDB-2pou:
The crystal structure of the human carbonic anhydrase II in complex with 4,5-dichloro-benzene-1,3-disulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

PDB-2pov:
The crystal structure of the human carbonic anhydrase II in complex with 4-amino-6-chloro-benzene-1,3-disulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

PDB-2pow:
The crystal structure of the human carbonic anhydrase II in complex with 4-amino-6-trifluoromethyl-benzene-1,3-disulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-I7A:
4,5-DICHLOROBENZENE-1,3-DISULFONAMIDE / inhibitor*YM

ChemComp-HOH:
WATER

ChemComp-I7B:
4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDE

ChemComp-I7C:
4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-1,3-DISULFONAMIDE

Source
  • homo sapiens (human)
KeywordsLYASE / CARBONIC ANHYDRASE II / PROTEIN-INHIBITOR COMPLEXES

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