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25844453932
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The expression, crystallization and structure work on JNK1 and JNK3 will be published elsewhere (Xue, Y.; Geschwinder, G.).
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As part of a JNK3 inhibitor program, the AstraZeneca compound collection was screened in a scintillation proximity assay-based HTS that employed human recombinant JNK3 and a biotin tagged ATF-2. The activities & potencies of hits were subsequently confirmed in a conventional filter wash assay. For specific conditions see King, S.; Teague, S.; Xue, Y.; Swahn, B.-M. WO2003051277, 2003; Chem. Abstr. 2003, 139, 53019.
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Figures 1, 3, 4 and 5 were generated using PyMOL, Ref.: W.L. DeLano The PyMOL Molecular Graphics System 2002 DeLano Scientific San Carlos, CA, USA
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The PyMOL Molecular Graphics System
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The surface representation was made inside program PyMOL, it is the solvent contact surface (not solvent accessible surface), which is traced out by the vdw surfaces of the water atoms when in contact with the protein.
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