Data on the docking of phytoconstituents of betel plant and matcha green tea on SARS-CoV-2

Betel (Piper betle L.) and green tea (Camellia sinensis (L) O. Kuntze) have been used for a long time as traditional medicine. The docking of phytoconstituents contained in the betel plant was evaluated against M(pro), and matcha green tea was evaluated against five target receptors of SARS-CoV-2 as...

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Detalles Bibliográficos
Autores principales: Fatimawali, Maulana, Rizky Ramadhan, Windah, Axl Laurens Lukas, Wahongan, Irma Febrianti, Tumilaar, Sefren Geiner, Adam, Ahmad Akroman, Kepel, Billy Johnson, Bodhi, Widdhi, Tallei, Trina Ekawati
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2021
Materias:
Data Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8043915/
https://www.ncbi.nlm.nih.gov/pubmed/33869690
http://dx.doi.org/10.1016/j.dib.2021.107049
Descripción
Sumario:Betel (Piper betle L.) and green tea (Camellia sinensis (L) O. Kuntze) have been used for a long time as traditional medicine. The docking of phytoconstituents contained in the betel plant was evaluated against M(pro), and matcha green tea was evaluated against five target receptors of SARS-CoV-2 as follows: spike ectodomain structure (open state), receptor-binding domain (RDB), main protease (M(pro)), RNA-dependent RNA polymerase (RdRp), dan papain-like protease (PL(pro)). The evaluation was carried out based on the value of binding-free energy and the types of interactions of the amino acids at the receptors that interact with the ligands.

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