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Structure paper

Title2-substituted estradiol bis-sulfamates, multitargeted antitumor agents: synthesis, in vitro SAR, protein crystallography, and in vivo activity.
Journal, issue, pagesJ. Med. Chem., Vol. 49, Page 7683-7696, Year 2006
Publish dateMar 15, 2006 (structure data deposition date)
AuthorsLeese, M.P. / Leblond, B. / Smith, A. / Newman, S.P. / Di Fiore, A. / De Simone, G. / Supuran, C.T. / Purohit, A. / Reed, M.J. / Potter, B.V.
External linksJ. Med. Chem. / PubMed:17181151
MethodsX-ray diffraction
Resolution1.46 Å
Structure data

PDB-2gd8:
Crystal structure analysis of the human carbonic anhydrase II in complex with a 2-substituted estradiol bis-sulfamate
Method: X-RAY DIFFRACTION / Resolution: 1.46 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-PO1:
(9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,5(10)-TRIENE-3,17-DIYL DISULFAMATE

ChemComp-MBO:
MERCURIBENZOIC ACID

ChemComp-HOH:
WATER

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

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