6S41

CRYSTAL STRUCTURE OF PXR IN COMPLEX WITH XPC-7455

6S41 の概要

• エントリーDOI: 10.2210/pdb6s41/pdb
• 分子名称: Nuclear receptor subfamily 1 group I member 2, 4-[[(1~{S})-1-[2,5-bis(fluoranyl)phenyl]ethyl]amino]-5-chloranyl-2-fluoranyl-~{N}-(1,3-thiazol-4-yl)benzenesulfonamide (3 entities in total)
• 機能のキーワード: pregnane x receptor, nuclear receptor, nuclear protein
• 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: 74514.62

構造登録者

Focken, T.,Maskos, K.,Griessner, A.,Krapp, S. (登録日: 2019-06-26, 公開日: 2019-10-02, 最終更新日: 2024-05-15)

• 主引用文献: Focken, T.,Burford, K.,Grimwood, M.E.,Zenova, A.,Andrez, J.C.,Gong, W.,Wilson, M.,Taron, M.,Decker, S.,Lofstrand, V.,Chowdhury, S.,Shuart, N.,Lin, S.,Goodchild, S.J.,Young, C.,Soriano, M.,Tari, P.K.,Waldbrook, M.,Nelkenbrecher, K.,Kwan, R.,Lindgren, A.,de Boer, G.,Lee, S.,Sojo, L.,DeVita, R.J.,Cohen, C.J.,Wesolowski, S.S.,Johnson Jr., J.P.,Dehnhardt, C.M.,Empfield, J.R.; Identification of CNS-Penetrant Aryl Sulfonamides as Isoform-Selective NaV1.6 Inhibitors with Efficacy in Mouse Models of Epilepsy.; J.Med.Chem., 62:9618-9641, 2019; PubMed: 31525968; DOI: 10.1021/acs.jmedchem.9b01032

実験手法

X-RAY DIFFRACTION (2.7 Å)