Supplementary Material for "General Principles for Yield Optimization of Nucleoside Phosphorylase-Catalyzed Transglycosylations"

This is the supplementary material for our publication "General Principles for Yield Optimization of Nucleoside Phosphorylase-Catalyzed Transglycosylations".

The .pdf file contains the supplementary information: Author Contributions, Conflict of Interest, Sample analysis by HPLC, Table S1 and S1, Figure S1 and a suggested workflow for NPase-catalyzed nucleoside synthesis.

The .xlsx file contains an implementation of the simplified formula for yield prediction (equation (4) ), using previously reported thermodynamic data (10.5281/zenodo.3459298).

The Python code and all data calculated from numerical solutions of the system of equilibrium constraints is available elsewhere (10.5281/zenodo.3522588).

本材料为我们发表的论文《核苷磷酸化酶催化转糖基反应产率优化的通用原则》的补充资料。

该PDF文件包含以下补充信息：作者贡献、利益冲突、高效液相色谱（High Performance Liquid Chromatography，HPLC）样品分析、表S1与表S1、图S1，以及一套用于核苷磷酸化酶（Nucleoside Phosphorylase，NPase）催化核苷合成的推荐操作流程。

该XLSX文件实现了产率预测简化公式（公式4）的计算，所用热力学数据源自已公开的研究数据集（10.5281/zenodo.3459298）。

本研究的Python代码以及通过平衡约束体系数值求解得到的全部计算数据，可在其他公开数据源获取（10.5281/zenodo.3522588）。