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Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis
Acute bronchitis is a lower respiratory tract lung infection that causes bronchial inflammation. The known protein drug targets are peptidoglycan D, D-transpeptidase, and DNA topoisomerase 4 subunit A for bronchitis linked infections. These are the membrane associated macromolecules which takes a ma...
Autores principales: | , , , , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Biomedical Informatics
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8770410/ https://www.ncbi.nlm.nih.gov/pubmed/35095230 http://dx.doi.org/10.6026/97320630017557 |
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author | Beelagi, Mallikarjun S Bongale, Manoj Manjunath Jain, Anisha S Shiva Prasad, Kollur Patil, Sharanagouda S Mellappa, Govindappa Dharmashekar, Chandan Ashwini, P Triveni, R Shivamallu, Chandan Srinivasa, Chandrashekar |
author_facet | Beelagi, Mallikarjun S Bongale, Manoj Manjunath Jain, Anisha S Shiva Prasad, Kollur Patil, Sharanagouda S Mellappa, Govindappa Dharmashekar, Chandan Ashwini, P Triveni, R Shivamallu, Chandan Srinivasa, Chandrashekar |
author_sort | Beelagi, Mallikarjun S |
collection | PubMed |
description | Acute bronchitis is a lower respiratory tract lung infection that causes bronchial inflammation. The known protein drug targets are peptidoglycan D, D-transpeptidase, and DNA topoisomerase 4 subunit A for bronchitis linked infections. These are the membrane associated macromolecules which takes a major role in the formation of cell wall membrane by synthesising the cross-linked peptidoglycan. Therefore, it is of interest to design molecules with improved binding features with these protein targets. Hence, we document the molecular docking analysis data of four phytocompounds from Acacia farnesiana having optimal binding features with these targets linked to bronchitis for further consideration. |
format | Online Article Text |
id | pubmed-8770410 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | Biomedical Informatics |
record_format | MEDLINE/PubMed |
spelling | pubmed-87704102022-01-27 Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis Beelagi, Mallikarjun S Bongale, Manoj Manjunath Jain, Anisha S Shiva Prasad, Kollur Patil, Sharanagouda S Mellappa, Govindappa Dharmashekar, Chandan Ashwini, P Triveni, R Shivamallu, Chandan Srinivasa, Chandrashekar Bioinformation Research Article Acute bronchitis is a lower respiratory tract lung infection that causes bronchial inflammation. The known protein drug targets are peptidoglycan D, D-transpeptidase, and DNA topoisomerase 4 subunit A for bronchitis linked infections. These are the membrane associated macromolecules which takes a major role in the formation of cell wall membrane by synthesising the cross-linked peptidoglycan. Therefore, it is of interest to design molecules with improved binding features with these protein targets. Hence, we document the molecular docking analysis data of four phytocompounds from Acacia farnesiana having optimal binding features with these targets linked to bronchitis for further consideration. Biomedical Informatics 2021-05-31 /pmc/articles/PMC8770410/ /pubmed/35095230 http://dx.doi.org/10.6026/97320630017557 Text en © 2021 Biomedical Informatics https://creativecommons.org/licenses/by/3.0/This is an Open Access article which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. This is distributed under the terms of the Creative Commons Attribution License. |
spellingShingle | Research Article Beelagi, Mallikarjun S Bongale, Manoj Manjunath Jain, Anisha S Shiva Prasad, Kollur Patil, Sharanagouda S Mellappa, Govindappa Dharmashekar, Chandan Ashwini, P Triveni, R Shivamallu, Chandan Srinivasa, Chandrashekar Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title | Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title_full | Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title_fullStr | Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title_full_unstemmed | Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title_short | Molecular docking analysis of phytocompounds from Acacia farnesiana with protein targets linked to bronchitis |
title_sort | molecular docking analysis of phytocompounds from acacia farnesiana with protein targets linked to bronchitis |
topic | Research Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8770410/ https://www.ncbi.nlm.nih.gov/pubmed/35095230 http://dx.doi.org/10.6026/97320630017557 |
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