Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses

The evaluation of the evolutionary relationships is exceptionally important for the taxonomy of viruses, which is a rapidly expanding area of research. The classification of viral groups belonging to the realm <i>Duplodnaviria</i>, which include tailed bacteriophages, head-tailed archaea...

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Main Authors: Peter Evseev, Daria Gutnik, Mikhail Shneider, Konstantin Miroshnikov
Format: Article
Language:English
Published: MDPI AG 2023-01-01
Series:Biomolecules
Subjects:
Online Access:https://www.mdpi.com/2218-273X/13/1/110
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author Peter Evseev
Daria Gutnik
Mikhail Shneider
Konstantin Miroshnikov
author_facet Peter Evseev
Daria Gutnik
Mikhail Shneider
Konstantin Miroshnikov
author_sort Peter Evseev
collection DOAJ
description The evaluation of the evolutionary relationships is exceptionally important for the taxonomy of viruses, which is a rapidly expanding area of research. The classification of viral groups belonging to the realm <i>Duplodnaviria</i>, which include tailed bacteriophages, head-tailed archaeal viruses and herpesviruses, has undergone many changes in recent years and continues to improve. One of the challenging tasks of <i>Duplodnaviria</i> taxonomy is the classification of high-ranked taxa, including families and orders. At the moment, only 17 of 50 families have been assigned to orders. The evaluation of the evolutionary relationships between viruses is complicated by the high level of divergence of viral proteins. However, the development of structure prediction algorithms, including the award-winning AlphaFold, encourages the use of the results of structural predictions to clarify the evolutionary history of viral proteins. In this study, the evolutionary relationships of two conserved viral proteins, the major capsid protein and terminase, representing different viruses, including all classified <i>Duplodnaviria</i> families, have been analysed using AlphaFold modelling. This analysis has been undertaken using structural comparisons and different phylogenetic methods. The results of the analyses mainly indicated the high quality of AlphaFold modelling and the possibility of using the AlphaFold predictions, together with other methods, for the reconstruction of the evolutionary relationships between distant viral groups. Based on the results of this integrated approach, assumptions have been made about refining the taxonomic classification of bacterial and archaeal <i>Duplodnaviria</i> groups, and problems relating to the taxonomic classification of <i>Duplodnaviria</i> have been discussed.
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spelling doaj.art-103607a386f741c6807f7c619f1a11882023-11-30T21:22:55ZengMDPI AGBiomolecules2218-273X2023-01-0113111010.3390/biom13010110Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> VirusesPeter Evseev0Daria Gutnik1Mikhail Shneider2Konstantin Miroshnikov3Shemyakin-Ovchinnikov Institute of Bioorganic Chemistry, Russian Academy of Sciences, Miklukho-Maklaya Str., 117997 Moscow, RussiaLimnological Institute, Siberian Branch of the Russian Academy of Sciences, 664033 Irkutsk, RussiaShemyakin-Ovchinnikov Institute of Bioorganic Chemistry, Russian Academy of Sciences, Miklukho-Maklaya Str., 117997 Moscow, RussiaShemyakin-Ovchinnikov Institute of Bioorganic Chemistry, Russian Academy of Sciences, Miklukho-Maklaya Str., 117997 Moscow, RussiaThe evaluation of the evolutionary relationships is exceptionally important for the taxonomy of viruses, which is a rapidly expanding area of research. The classification of viral groups belonging to the realm <i>Duplodnaviria</i>, which include tailed bacteriophages, head-tailed archaeal viruses and herpesviruses, has undergone many changes in recent years and continues to improve. One of the challenging tasks of <i>Duplodnaviria</i> taxonomy is the classification of high-ranked taxa, including families and orders. At the moment, only 17 of 50 families have been assigned to orders. The evaluation of the evolutionary relationships between viruses is complicated by the high level of divergence of viral proteins. However, the development of structure prediction algorithms, including the award-winning AlphaFold, encourages the use of the results of structural predictions to clarify the evolutionary history of viral proteins. In this study, the evolutionary relationships of two conserved viral proteins, the major capsid protein and terminase, representing different viruses, including all classified <i>Duplodnaviria</i> families, have been analysed using AlphaFold modelling. This analysis has been undertaken using structural comparisons and different phylogenetic methods. The results of the analyses mainly indicated the high quality of AlphaFold modelling and the possibility of using the AlphaFold predictions, together with other methods, for the reconstruction of the evolutionary relationships between distant viral groups. Based on the results of this integrated approach, assumptions have been made about refining the taxonomic classification of bacterial and archaeal <i>Duplodnaviria</i> groups, and problems relating to the taxonomic classification of <i>Duplodnaviria</i> have been discussed.https://www.mdpi.com/2218-273X/13/1/110viral taxonomyevolution of virusesAlphaFoldmajor capsid proteinterminaseprotein structure comparison
spellingShingle Peter Evseev
Daria Gutnik
Mikhail Shneider
Konstantin Miroshnikov
Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
Biomolecules
viral taxonomy
evolution of viruses
AlphaFold
major capsid protein
terminase
protein structure comparison
title Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
title_full Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
title_fullStr Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
title_full_unstemmed Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
title_short Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
title_sort use of an integrated approach involving alphafold predictions for the evolutionary taxonomy of i duplodnaviria i viruses
topic viral taxonomy
evolution of viruses
AlphaFold
major capsid protein
terminase
protein structure comparison
url https://www.mdpi.com/2218-273X/13/1/110
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AT mikhailshneider useofanintegratedapproachinvolvingalphafoldpredictionsfortheevolutionarytaxonomyofiduplodnaviriaiviruses
AT konstantinmiroshnikov useofanintegratedapproachinvolvingalphafoldpredictionsfortheevolutionarytaxonomyofiduplodnaviriaiviruses