Computational design of orthogonal nucleoside kinases

[摘要]：We report the computational enzyme design of an orthogonal nucleoside analog kinase for 30-deoxythymidine. The best kinase variant shows an 8500-fold change in substrate specificity, resulting from a 4.6-fold gain in catalytic efficiency for the nucleoside analog and a 2000-fold decline for the native substrate thymidine.

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