5M96

Synthesis and biological evaluation of new triazolo and imidazolopyridine RORgt inverse agonists

5M96 の概要

• エントリーDOI: 10.2210/pdb5m96/pdb
• 分子名称: Nuclear receptor ROR-gamma, ~{N}-[8-[[(3~{S})-4-cyclopentylcarbonyl-3-methyl-piperazin-1-yl]methyl]-7-methyl-imidazo[1,2-a]pyridin-6-yl]-2-methyl-pyrimidine-5-carboxamide (3 entities in total)
• 機能のキーワード: nuclear hormone receptor, ligand-binding domain, inverse agonist, transcription
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 55510.23

構造登録者

Kallen, J. (登録日: 2016-10-31, 公開日: 2016-12-14, 最終更新日: 2024-05-08)

• 主引用文献: Hintermann, S.,Guntermann, C.,Mattes, H.,Carcache, D.A.,Wagner, J.,Vulpetti, A.,Billich, A.,Dawson, J.,Kaupmann, K.,Kallen, J.,Stringer, R.,Orain, D.; Synthesis and Biological Evaluation of New Triazolo- and Imidazolopyridine ROR gamma t Inverse Agonists.; ChemMedChem, 11:2640-2648, 2016; PubMed: 27902884; DOI: 10.1002/cmdc.201600500

実験手法

X-RAY DIFFRACTION (1.77 Å)