7UMV

Structure of MAP kinase phosphatase 5 in complex with 3,3-dimethyl-1-((5,6-dihydropyrido[2,3-h]quinazolin-2-yl)thio)butan-2-one, an allosteric inhibitor

7UMV の概要

• エントリーDOI: 10.2210/pdb7umv/pdb
• 分子名称: Dual specificity protein phosphatase 10, 1-{[(10aP)-5,6-dihydropyrido[2,3-h]quinazolin-2-yl]sulfanyl}-3,3-dimethylbutan-2-one, ACETATE ION, ... (4 entities in total)
• 機能のキーワード: phosphatase, protein-tyrosine phosphatase, dual specificity phosphatase, phosphatase-inhibitor complex, hydrolase-inhibitor complex, hydrolase/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: 17822.42

構造登録者

Gannam, Z.T.K.,Jamali, H.,Lolis, E.,Anderson, K.S.,Ellman, J.A.,Bennett, A.M. (登録日: 2022-04-07, 公開日: 2022-10-05, 最終更新日: 2023-10-18)

• 主引用文献: Gannam, Z.T.K.,Jamali, H.,Kweon, O.S.,Herrington, J.,Shillingford, S.R.,Papini, C.,Gentzel, E.,Lolis, E.,Bennett, A.M.,Ellman, J.A.,Anderson, K.S.; Defining the structure-activity relationship for a novel class of allosteric MKP5 inhibitors.; Eur.J.Med.Chem., 243:114712-114712, 2022; PubMed: 36116232; DOI: 10.1016/j.ejmech.2022.114712

実験手法

X-RAY DIFFRACTION (1.8 Å)