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Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach
Universal stress protein (USP) is a novel target to overcome the tuberculosis resistance. Our present study enlightens the possibilities of some natural polyphenols as an antioxidant for USP. The study has shown some molecular simulations of some selected natural antioxidants with USP. We have consi...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Medknow Publications & Media Pvt Ltd
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4215480/ https://www.ncbi.nlm.nih.gov/pubmed/25364695 http://dx.doi.org/10.4103/2231-4040.143036 |
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author | Aanandhi, M. Vijey Bhattacherjee, Debojit George, P. Samuel Gideon Ray, Anirban |
author_facet | Aanandhi, M. Vijey Bhattacherjee, Debojit George, P. Samuel Gideon Ray, Anirban |
author_sort | Aanandhi, M. Vijey |
collection | PubMed |
description | Universal stress protein (USP) is a novel target to overcome the tuberculosis resistance. Our present study enlightens the possibilities of some natural polyphenols as an antioxidant for USP. The study has shown some molecular simulations of some selected natural antioxidants with USP. We have considered USP (Rv1636) strain for homology modeling and the selected template was taken for the docking study. Curcumin, catechin, reservetrol has shown ARG 136 (1.8Å) hydrogen bonding and two ionic bonding with carboxyl group of curcumin with LEU 130 (3.3Å) and ASN 144 (3.4Å) respectively. INH was taken for the standard molecule to perform molecular simulation. It showed poor binding interaction with the target, that is, −5.18 kcal, and two hydrogen bonding with SER 140 (1.887Å), ARG 147 (2.064Å) respectively. The study indicates possible new generation curcumin analogue for future therapy to down-regulate USP. |
format | Online Article Text |
id | pubmed-4215480 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | Medknow Publications & Media Pvt Ltd |
record_format | MEDLINE/PubMed |
spelling | pubmed-42154802014-10-31 Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach Aanandhi, M. Vijey Bhattacherjee, Debojit George, P. Samuel Gideon Ray, Anirban J Adv Pharm Technol Res Original Article Universal stress protein (USP) is a novel target to overcome the tuberculosis resistance. Our present study enlightens the possibilities of some natural polyphenols as an antioxidant for USP. The study has shown some molecular simulations of some selected natural antioxidants with USP. We have considered USP (Rv1636) strain for homology modeling and the selected template was taken for the docking study. Curcumin, catechin, reservetrol has shown ARG 136 (1.8Å) hydrogen bonding and two ionic bonding with carboxyl group of curcumin with LEU 130 (3.3Å) and ASN 144 (3.4Å) respectively. INH was taken for the standard molecule to perform molecular simulation. It showed poor binding interaction with the target, that is, −5.18 kcal, and two hydrogen bonding with SER 140 (1.887Å), ARG 147 (2.064Å) respectively. The study indicates possible new generation curcumin analogue for future therapy to down-regulate USP. Medknow Publications & Media Pvt Ltd 2014 /pmc/articles/PMC4215480/ /pubmed/25364695 http://dx.doi.org/10.4103/2231-4040.143036 Text en Copyright: © Journal of Advanced Pharmaceutical Technology & Research http://creativecommons.org/licenses/by-nc-sa/3.0 This is an open-access article distributed under the terms of the Creative Commons Attribution-Noncommercial-Share Alike 3.0 Unported, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Original Article Aanandhi, M. Vijey Bhattacherjee, Debojit George, P. Samuel Gideon Ray, Anirban Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title | Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title_full | Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title_fullStr | Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title_full_unstemmed | Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title_short | Natural polyphenols down-regulate universal stress protein in Mycobacterium tuberculosis: An in-silico approach |
title_sort | natural polyphenols down-regulate universal stress protein in mycobacterium tuberculosis: an in-silico approach |
topic | Original Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4215480/ https://www.ncbi.nlm.nih.gov/pubmed/25364695 http://dx.doi.org/10.4103/2231-4040.143036 |
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