Molecular mechanisms of detection and discrimination of dynamic signals
Abstract Many molecules decode not only the concentration of cellular signals, but also their temporal dynamics. However, little is known about the mechanisms that underlie the detection and discrimination of dynamic signals. We used computational modelling of the interaction of a ligand with multip...
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Nature Portfolio
2018
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oai:doaj.org-article:fb4eef05566248a68fa7b3cd3074cb2e2021-12-02T15:09:12ZMolecular mechanisms of detection and discrimination of dynamic signals10.1038/s41598-018-20842-y2045-2322https://doaj.org/article/fb4eef05566248a68fa7b3cd3074cb2e2018-02-01T00:00:00Zhttps://doi.org/10.1038/s41598-018-20842-yhttps://doaj.org/toc/2045-2322Abstract Many molecules decode not only the concentration of cellular signals, but also their temporal dynamics. However, little is known about the mechanisms that underlie the detection and discrimination of dynamic signals. We used computational modelling of the interaction of a ligand with multiple targets to investigate how kinetic and thermodynamic parameters regulate their capabilities to respond to dynamic signals. Our results demonstrated that the detection and discrimination of temporal features of signal inputs occur for reactions proceeding outside mass-action equilibrium. For these reactions, thermodynamic parameters such as affinity do not predict their outcomes. Additionally, we showed that, at non-equilibrium, the association rate constants determine the amount of product formed in reversible reactions. In contrast, the dissociation rate constants regulate the time interval required for reversible reactions to achieve equilibrium and, consequently, control their ability to detect and discriminate dynamic features of cellular signals.G. AntunesA. C. RoqueF. M. Simoes-de-SouzaNature PortfolioarticleMedicineRScienceQENScientific Reports, Vol 8, Iss 1, Pp 1-14 (2018) |
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Medicine R Science Q G. Antunes A. C. Roque F. M. Simoes-de-Souza Molecular mechanisms of detection and discrimination of dynamic signals |
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Abstract Many molecules decode not only the concentration of cellular signals, but also their temporal dynamics. However, little is known about the mechanisms that underlie the detection and discrimination of dynamic signals. We used computational modelling of the interaction of a ligand with multiple targets to investigate how kinetic and thermodynamic parameters regulate their capabilities to respond to dynamic signals. Our results demonstrated that the detection and discrimination of temporal features of signal inputs occur for reactions proceeding outside mass-action equilibrium. For these reactions, thermodynamic parameters such as affinity do not predict their outcomes. Additionally, we showed that, at non-equilibrium, the association rate constants determine the amount of product formed in reversible reactions. In contrast, the dissociation rate constants regulate the time interval required for reversible reactions to achieve equilibrium and, consequently, control their ability to detect and discriminate dynamic features of cellular signals. |
format |
article |
author |
G. Antunes A. C. Roque F. M. Simoes-de-Souza |
author_facet |
G. Antunes A. C. Roque F. M. Simoes-de-Souza |
author_sort |
G. Antunes |
title |
Molecular mechanisms of detection and discrimination of dynamic signals |
title_short |
Molecular mechanisms of detection and discrimination of dynamic signals |
title_full |
Molecular mechanisms of detection and discrimination of dynamic signals |
title_fullStr |
Molecular mechanisms of detection and discrimination of dynamic signals |
title_full_unstemmed |
Molecular mechanisms of detection and discrimination of dynamic signals |
title_sort |
molecular mechanisms of detection and discrimination of dynamic signals |
publisher |
Nature Portfolio |
publishDate |
2018 |
url |
https://doaj.org/article/fb4eef05566248a68fa7b3cd3074cb2e |
work_keys_str_mv |
AT gantunes molecularmechanismsofdetectionanddiscriminationofdynamicsignals AT acroque molecularmechanismsofdetectionanddiscriminationofdynamicsignals AT fmsimoesdesouza molecularmechanismsofdetectionanddiscriminationofdynamicsignals |
_version_ |
1718387915745132544 |