7UYU

Crystal structure of TYK2 kinase domain in complex with compound 30

7UYU の概要

• エントリーDOI: 10.2210/pdb7uyu/pdb
• 分子名称: Non-receptor tyrosine-protein kinase TYK2, 2-(2,6-difluorophenyl)-4-[4-(pyrrolidine-1-carbonyl)anilino]-5H-pyrrolo[3,4-b]pyridin-5-one, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: non-receptor tyrosine-protein kinase 2, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 34171.86

構造登録者

Toms, A.V.,Leit, S.,Greenwood, J.R.,Mondal, S.,Carriero, S.,Dahlgren, M.,Harriman, G.C.,Kennedy-Smith, J.J.,Kapeller, R.,Lawson, J.P.,Romero, D.L.,Shelley, M.,Wester, R.T.,Westlin, W.,Mc Elwee, J.J.,Miao, W.,Edmondson, S.D.,Massee, C.E. (登録日: 2022-05-07, 公開日: 2022-08-24)

• 主引用文献: Leit, S.,Greenwood, J.R.,Mondal, S.,Carriero, S.,Dahlgren, M.,Harriman, G.C.,Kennedy-Smith, J.J.,Kapeller, R.,Lawson, J.P.,Romero, D.L.,Toms, A.V.,Shelley, M.,Wester, R.T.,Westlin, W.,McElwee, J.J.,Miao, W.,Edmondson, S.D.,Masse, C.E.; Potent and selective TYK2-JH1 inhibitors highly efficacious in rodent model of psoriasis.; Bioorg.Med.Chem.Lett., 73:128891-128891, 2022; PubMed: 35842205; DOI: 10.1016/j.bmcl.2022.128891

実験手法

X-RAY DIFFRACTION (2.05 Å)