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Reverse Docking on Five Original PPO Structures: Plant, Bacterial, and Human


 
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1. Title Title of document Reverse Docking on Five Original PPO Structures: Plant, Bacterial, and Human
 
2. Creator Author's name, affiliation, country O. Abdessadak, H. Hajji, S. Mehanned, M. Aziz Ajana, T. Lakhlifi, M. Bouachrine; Morocco
 
3. Subject Discipline(s)
 
3. Subject Keyword(s) PPO, N-phenylphthalimide, Reverse Docking, MD simulations.
 
4. Description Abstract

Protoporphyrinogen oxidase has known remarkable interest in biochemical studies, it is considered a perfect target for the development of new herbicides. PPO herbicides have been developed for more than forty years, and research on this enzyme remains until today, to find new more effective herbicides. In this work, we investigated the inhibitory activity of a compound derived from N-phenylphthalimide with the highest inhibitory activity among a series of 29 molecules, on five PPO structures from various origins, including Plant origin, bacterial, and human, we have based on Reverse Docking, to know the affinity between the inhibitor and the five targets, and the different ligand-receptor interactions. As well as Molecular Dynamics. Interesting results have been obtained, which may help us to discover new targets concerning herbicides.

 
5. Publisher Organizing agency, location
 
6. Contributor Sponsor(s)
 
7. Date (YYYY-MM-DD) 16-06-2022
 
8. Type Status & genre Peer-reviewed Article
 
8. Type Type
 
9. Format File format PDF
 
10. Identifier Uniform Resource Identifier https://revues.imist.ma/index.php/morjchem/article/view/33065
 
10. Identifier Digital Object Identifier (DOI) https://doi.org/10.48317/IMIST.PRSM/morjchem-v10i3.33065
 
11. Source Title; vol., no. (year) Moroccan Journal of Chemistry; Vol 10, No 3 (2022)
 
12. Language English=en en
 
13. Relation Supp. Files
 
14. Coverage Geo-spatial location, chronological period, research sample (gender, age, etc.)
 
15. Rights Copyright and permissions Copyright (c) 2022 Moroccan Journal of Chemistry