7B39

Allene-Based Design of a Noncalcemic Vitamin D Receptor Agonist

Summary for 7B39

• Entry DOI: 10.2210/pdb7b39/pdb
• Descriptor: Vitamin D3 receptor A, Nuclear receptor coactivator 1, (1R,3S,Z)-5-(2-((3aS,7aS,E)-1-(6-hydroxy-6-methylhept-1-en-1-ylidene)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol, ... (5 entities in total)
• Functional Keywords: vitamin d receptor, gene regulation
• Biological source: Danio rerio (Zebrafish); More
• Total number of polymer chains: 2
• Total formula weight: 36308.39

Authors

Rochel, N. (deposition date: 2020-11-29, release date: 2021-09-01, Last modification date: 2024-01-31)

• Primary citation: Fraga, R.,Len, K.,Lutzing, R.,Laverny, G.,Loureiro, J.,Maestro, M.A.,Rochel, N.,Rodriguez-Borges, E.,Mourino, A.; Design, Synthesis, Evaluation and Structure of Allenic 1 alpha ,25-Dihydroxyvitamin D 3 Analogs with Locked Mobility at C-17.; Chemistry, 27:13384-13389, 2021; PubMed: 34224173; DOI: 10.1002/chem.202101578

Experimental method

X-RAY DIFFRACTION (2.13 Å)