8V42
Structure of Human Vaccinia-related Kinase 1 (VRK1) Bound to ACH000400
Summary for 8V42
Entry DOI | 10.2210/pdb8v42/pdb |
Descriptor | 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) |
Functional Keywords | protein kinase, inhibitor, co-crystal, transferase |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 4 |
Total formula weight | 165895.62 |
Authors | Counago, R.M.,de Souza, G.P.,Azevedo, A.,Guimaraes, C.,Mascarello, A.,Gama, F.,Ferreira, M.,Arruda, P. (deposition date: 2023-11-28, release date: 2024-09-04) |
Primary citation | 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 Cited by PubMed: 38780468DOI: 10.1021/acs.jmedchem.3c02250 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.3 Å) |
Structure validation
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