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Structure paper

TitleStructure-function study of gemini derivatives with two different side chains at C-20, Gemini-0072 and Gemini-0097.
Journal, issue, pagesMedchemcomm, Vol. 2, Page 424-429, Year 2011
Publish dateJul 21, 2010 (structure data deposition date)
AuthorsHuet, T. / Maehr, H. / Lee, H.J. / Uskokovic, M.R. / Suh, N. / Moras, D. / Rochel, N.
External linksMedchemcomm / PubMed:22180837
MethodsX-ray diffraction
Resolution2.4007 - 2.5001 Å
Structure data

PDB-3o1d:
Structure-function study of Gemini derivatives with two different side chains at C-20, Gemini-0072 and Gemini-0097.
Method: X-RAY DIFFRACTION / Resolution: 2.4007 Å

PDB-3o1e:
Structure-function of Gemini derivatives with two different side chains at C-20, Gemini-0072 and Gemini-0097.
Method: X-RAY DIFFRACTION / Resolution: 2.5001 Å

Chemicals

ChemComp-G72:
(1R,3R,7E,17beta)-17-[(1S)-6,6,6-trifluoro-5-hydroxy-1-(4-hydroxy-4-methylpentyl)-5-(trifluoromethyl)hex-3-yn-1-yl]-9,10-secoestra-5,7-diene-1,3-diol

ChemComp-HOH:
WATER

ChemComp-H97:
(1R,3R,7E,17beta)-17-[(1R)-6,6,6-trifluoro-5-hydroxy-1-(4-hydroxy-4-methylpentyl)-5-(trifluoromethyl)hex-3-yn-1-yl]-9,1

Source
  • danio rerio (zebrafish)
  • homo sapiens (human)
KeywordsTRANSCRIPTION/TRANSCRIPTION ACTIVATOR / Transcription factor / vitamin D / Nucleus / TRANSCRIPTION-TRANSCRIPTION ACTIVATOR complex

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