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Structure paper

TitleStructure-function relationships and crystal structures of the vitamin D receptor bound 2 alpha-methyl-(20S,23S)- and 2 alpha-methyl-(20S,23R)-epoxymethano-1 alpha,25-dihydroxyvitamin D3
Journal, issue, pagesJ. Med. Chem., Vol. 53, Page 1159-1171, Year 2010
Publish dateJun 25, 2009 (structure data deposition date)
AuthorsAntony, P. / Sigueiro, R. / Huet, T. / Sato, Y. / Ramalanjaona, N. / Rodrigues, L.C. / Mourino, A. / Moras, D. / Rochel, N.
External linksJ. Med. Chem. / PubMed:20070104
MethodsX-ray diffraction
Resolution1.45 - 1.72 Å
Structure data

PDB-3a3z:
Crystal structure of the human VDR ligand binding domain bound to the synthetic agonist compound 2alpha-methyl-AMCR277A(C23S)
Method: X-RAY DIFFRACTION / Resolution: 1.72 Å

PDB-3a40:
Crystal structure of the human VDR ligand binding domain bound to the synthetic agonist compound 2alpha-methyl-AMCR277B(C23R)
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

Chemicals

ChemComp-2MV:
(1S,2S,3R,5Z,7E,14beta,17alpha)-17-[(2S,4S)-4-(2-hydroxy-2-methylpropyl)-2-methyltetrahydrofuran-2-yl]-2-methyl-9,10-secoandrosta-5,7,10-triene-1,3-diol

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-23R:
(1S,2S,3R,5Z,7E,14beta,17alpha,23R)-23-(2-hydroxy-2-methylpropyl)-2-methyl-20,24-epoxy-9,10-secochola-5,7,10-triene-1,3-diol

Source
  • homo sapiens (human)
KeywordsGENE REGULATION / Transcription / Structural Genomics / SPINE2 / Structural Proteomics in Europe 2 / SPINE-2

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