8V42

Structure of Human Vaccinia-related Kinase 1 (VRK1) Bound to ACH000400

8V42 の概要

• エントリーDOI: 10.2210/pdb8v42/pdb
• 分子名称: Serine/threonine-protein kinase VRK1, DI(HYDROXYETHYL)ETHER, (7S)-2-(3,5-difluoro-4-hydroxyanilino)-7-methyl-5-[(1,2-oxazol-5-yl)methyl]-8-(prop-2-yn-1-yl)-7,8-dihydropteridin-6(5H)-one, ... (5 entities in total)
• 機能のキーワード: protein kinase, inhibitor, co-crystal, transferase
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 165895.62

構造登録者

Counago, R.M.,de Souza, G.P.,Azevedo, A.,Guimaraes, C.,Mascarello, A.,Gama, F.,Ferreira, M.,Arruda, P. (登録日: 2023-11-28, 公開日: 2024-09-04)

• 主引用文献: de Souza Gama, F.H.,Dutra, L.A.,Hawgood, M.,Dos Reis, C.V.,Serafim, R.A.M.,Ferreira Jr., M.A.,Teodoro, B.V.M.,Takarada, J.E.,Santiago, A.S.,Balourdas, D.I.,Nilsson, A.S.,Urien, B.,Almeida, V.M.,Gileadi, C.,Ramos, P.Z.,Salmazo, A.,Vasconcelos, S.N.S.,Cunha, M.R.,Mueller, S.,Knapp, S.,Massirer, K.B.,Elkins, J.M.,Gileadi, O.,Mascarello, A.,Lemmens, B.B.L.G.,Guimaraes, C.R.W.,Azevedo, H.,Counago, R.M.; Novel Dihydropteridinone Derivatives As Potent Inhibitors of the Understudied Human Kinases Vaccinia-Related Kinase 1 and Casein Kinase 1 delta / epsilon.; J.Med.Chem., 67:8609-8629, 2024; PubMed: 38780468; DOI: 10.1021/acs.jmedchem.3c02250

実験手法

X-RAY DIFFRACTION (2.3 Å)