6G3O

Crystal structure of human HDAC2 in complex with (R)-6-[3,4-Dioxo-2-(4-trifluoromethoxy-phenylamino)-cyclobut-1-enylamino]-heptanoic acid hydroxyamide

6G3O の概要

• エントリーDOI: 10.2210/pdb6g3o/pdb
• 分子名称: Histone deacetylase 2, ZINC ION, CALCIUM ION, ... (9 entities in total)
• 機能のキーワード: hdac inhibitors, squaramide, histone, hydrolase-hydrolase inhibitor complex, hydrolase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 129529.01

構造登録者

Isabet, T.,Aurelly, M.,Chantalat, L.,Thoreau, E. (登録日: 2018-03-26, 公開日: 2018-06-27, 最終更新日: 2018-08-29)

• 主引用文献: Fournier, J.F.,Bhurruth-Alcor, Y.,Musicki, B.,Aubert, J.,Aurelly, M.,Bouix-Peter, C.,Bouquet, K.,Chantalat, L.,Delorme, M.,Drean, B.,Duvert, G.,Fleury-Bregeot, N.,Gauthier, B.,Grisendi, K.,Harris, C.S.,Hennequin, L.F.,Isabet, T.,Joly, F.,Lafitte, G.,Millois, C.,Morgentin, R.,Pascau, J.,Piwnica, D.,Rival, Y.,Soulet, C.,Thoreau, E.,Tomas, L.; Squaramides as novel class I and IIB histone deacetylase inhibitors for topical treatment of cutaneous t-cell lymphoma.; Bioorg. Med. Chem. Lett., 28:2985-2992, 2018; PubMed: 30122227; DOI: 10.1016/j.bmcl.2018.06.029

実験手法

X-RAY DIFFRACTION (2.27 Å)