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首页> 外文期刊>Journal of molecular catalysis, B. Enzymatic >Activation of mandelate racemase via immobilization in lyotropic liquid crystals for biocatalysis in organic solvents: application and modeling
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Activation of mandelate racemase via immobilization in lyotropic liquid crystals for biocatalysis in organic solvents: application and modeling

机译:通过固定在溶致液晶中活化扁桃酸酯消旋酶,以在有机溶剂中进行生物催化:应用和建模

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摘要

Mandelate racemase from Pseudomonas putida ATCC 12633 could be activated in an organic solvent by immobilization in lyotropic liquid crystals (LC). A theoretical model for a system, that consisted of an organic solvent phase to solve the nonpolar substrate and the LC phase with the immobilized enzyme was developed. The model included the biocatalytic reaction and the mass transfer-in-between the within the phases. By means of the finite element method (FEM) this novel was transferred into a computer program, which was used as a tool for the simulation of the racemization of D-mandelic acid by mandelate racemase in the organic solvent (di-n-butyl ether). The experimental results at temperatures ranging from 20 to 60 deg C and starting concentrations of D-mandelic acid between 40 and 80 mmol l~(-1) in the organic solvent phase could be simulated by the model with high accuracy. Furthermore, the model was used to vary the geometry of the system to minimize mass transfer limitations, which represent a crucial limitation for this system.
机译:恶臭假单胞菌ATCC 12633的扁桃酸酯消旋酶可通过固定在溶致液晶(LC)中而在有机溶剂中激活。建立了一个系统的理论模型,该系统由用于解决非极性底物的有机溶剂相和固定化酶的LC相组成。该模型包括生物催化反应和各相之间的传质。通过有限元方法(FEM),将这本小说转移到计算机程序中,该程序用作在有机溶剂(二正丁基醚)中通过扁桃酸酯消旋酶模拟D-扁桃酸外消旋化的工具。 )。通过该模型可以高精度地模拟在20至60摄氏度的温度下,有机溶剂相中D-扁桃酸起始浓度在40至80 mmol l〜(-1)之间的实验结果。此外,该模型用于改变系统的几何形状以最小化传质限制,这代表了该系统的关键限制。

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