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A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks

[Image: see text] In order to create artificial enzymatic networks capable of increasingly complex behavior, an improved methodology in understanding and controlling the kinetics of these networks is needed. Here, we introduce a Bayesian analysis method allowing for the accurate inference of enzyme...

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Autores principales: Baltussen, Mathieu G., van de Wiel, Jeroen, Fernández Regueiro, Cristina Lía, Jakštaitė, Miglė, Huck, Wilhelm T. S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9134183/
https://www.ncbi.nlm.nih.gov/pubmed/35549162
http://dx.doi.org/10.1021/acs.analchem.2c00659
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author Baltussen, Mathieu G.
van de Wiel, Jeroen
Fernández Regueiro, Cristina Lía
Jakštaitė, Miglė
Huck, Wilhelm T. S.
author_facet Baltussen, Mathieu G.
van de Wiel, Jeroen
Fernández Regueiro, Cristina Lía
Jakštaitė, Miglė
Huck, Wilhelm T. S.
author_sort Baltussen, Mathieu G.
collection PubMed
description [Image: see text] In order to create artificial enzymatic networks capable of increasingly complex behavior, an improved methodology in understanding and controlling the kinetics of these networks is needed. Here, we introduce a Bayesian analysis method allowing for the accurate inference of enzyme kinetic parameters and determination of most likely reaction mechanisms, by combining data from different experiments and network topologies in a single probabilistic analysis framework. This Bayesian approach explicitly allows us to continuously improve our parameter estimates and behavior predictions by iteratively adding new data to our models, while automatically taking into account uncertainties introduced by the experimental setups or the chemical processes in general. We demonstrate the potential of this approach by characterizing systems of enzymes compartmentalized in beads inside flow reactors. The methods we introduce here provide a new approach to the design of increasingly complex artificial enzymatic networks, making the design of such networks more efficient, and robust against the accumulation of experimental errors.
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spelling pubmed-91341832022-05-27 A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks Baltussen, Mathieu G. van de Wiel, Jeroen Fernández Regueiro, Cristina Lía Jakštaitė, Miglė Huck, Wilhelm T. S. Anal Chem [Image: see text] In order to create artificial enzymatic networks capable of increasingly complex behavior, an improved methodology in understanding and controlling the kinetics of these networks is needed. Here, we introduce a Bayesian analysis method allowing for the accurate inference of enzyme kinetic parameters and determination of most likely reaction mechanisms, by combining data from different experiments and network topologies in a single probabilistic analysis framework. This Bayesian approach explicitly allows us to continuously improve our parameter estimates and behavior predictions by iteratively adding new data to our models, while automatically taking into account uncertainties introduced by the experimental setups or the chemical processes in general. We demonstrate the potential of this approach by characterizing systems of enzymes compartmentalized in beads inside flow reactors. The methods we introduce here provide a new approach to the design of increasingly complex artificial enzymatic networks, making the design of such networks more efficient, and robust against the accumulation of experimental errors. American Chemical Society 2022-05-12 2022-05-24 /pmc/articles/PMC9134183/ /pubmed/35549162 http://dx.doi.org/10.1021/acs.analchem.2c00659 Text en © 2022 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by/4.0/Permits the broadest form of re-use including for commercial purposes, provided that author attribution and integrity are maintained (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Baltussen, Mathieu G.
van de Wiel, Jeroen
Fernández Regueiro, Cristina Lía
Jakštaitė, Miglė
Huck, Wilhelm T. S.
A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title_full A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title_fullStr A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title_full_unstemmed A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title_short A Bayesian Approach to Extracting Kinetic Information from Artificial Enzymatic Networks
title_sort bayesian approach to extracting kinetic information from artificial enzymatic networks
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9134183/
https://www.ncbi.nlm.nih.gov/pubmed/35549162
http://dx.doi.org/10.1021/acs.analchem.2c00659
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