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TitleStructure-activity relationships of C-17 cyano-substituted estratrienes as anticancer agents
Journal, issue, pagesJ. Med. Chem., Vol. 51, Page 1295-1308, Year 2008
Publish dateNov 20, 2007 (structure data deposition date)
AuthorsLeese, M.P. / Jourdan, F.L. / Gaukroger, K. / Mahon, M.F. / Newman, S.P. / Foster, P.A. / Stengel, C. / Regis-Lydi, S. / Ferrandis, E. / Di Fiore, A. ...Leese, M.P. / Jourdan, F.L. / Gaukroger, K. / Mahon, M.F. / Newman, S.P. / Foster, P.A. / Stengel, C. / Regis-Lydi, S. / Ferrandis, E. / Di Fiore, A. / De Simone, G. / Supuran, C.T. / Purohit, A. / Reed, M.J. / Potter, B.V.
External linksJ. Med. Chem. / PubMed:18260615
MethodsX-ray diffraction
Resolution1.85 Å
Structure data

PDB-3bet:
Crystal structure of the human carbonic anhydrase II in complex with STX 641 at 1.85 angstroms resolution
Method: X-RAY DIFFRACTION / Resolution: 1.85 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CTF:
(17beta)-17-(cyanomethyl)-2-methoxyestra-1(10),2,4-trien-3-yl sulfamate

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsLYASE / Protein-inhibitor complex / Disease mutation / Metal-binding

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