5XPL

Crystal structure of VDR-LBD complexed with 22S-butyl-25-hydroxyphenyl-2-methylidene-19,26,27-trinor-25-oxo-1-hydroxyvitamin D3

5XPL の概要

• エントリーDOI: 10.2210/pdb5xpl/pdb
• 分子名称: Vitamin D3 receptor, Nuclear receptor coactivator 2, (4~{S})-4-[(1~{R})-1-[(1~{R},3~{a}~{S},4~{E},7~{a}~{R})-7~{a}-methyl-4-[2-[(3~{R},5~{R})-4-methylidene-3,5-bis(oxidanyl )cyclohexylidene]ethylidene]-2,3,3~{a},5,6,7-hexahydro-1~{H}-inden-1-yl]ethyl]-1-(4-hydroxyphenyl)octan-1-one, ... (4 entities in total)
• 機能のキーワード: transcription, vitamin d3, vdr, vdre, rxr, co-factors, src2-3, antagonist
• 由来する生物種: Rattus norvegicus (Rat); 詳細
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 32723.65

構造登録者

Kato, A.,Itoh, T.,Yamamoto, K. (登録日: 2017-06-03, 公開日: 2018-06-06, 最終更新日: 2024-03-27)

• 主引用文献: Kato, A.,Yamao, M.,Hashihara, Y.,Ishida, H.,Itoh, T.,Yamamoto, K.; Vitamin D Analogues with a p-Hydroxyphenyl Group at the C25 Position: Crystal Structure of Vitamin D Receptor Ligand-Binding Domain Complexed with the Ligand Explains the Mechanism Underlying Full Antagonistic Action; J. Med. Chem., 60:8394-8406, 2017; PubMed: 28954197; DOI: 10.1021/acs.jmedchem.7b00819

実験手法

X-RAY DIFFRACTION (2.05 Å)