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 Mpro, and matcha green tea was evaluated against five target receptors of SARS-CoV-2 as f...

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Published inData in brief Vol. 36; p. 107049
Main Authors 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
Format Journal Article
LanguageEnglish
Published Netherlands Elsevier Inc 01.06.2021
Elsevier
Subjects
Antiviral
Betel
Data
Docking
In silico
Matcha green tea
Phytoconstituent
SARS-CoV-2
SARS-CoV-2
Matcha green tea
Betel
In silico
Docking
Antiviral
Phytoconstituent
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Summary: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 Mpro, 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 (Mpro), RNA-dependent RNA polymerase (RdRp), dan papain-like protease (PLpro). 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.
Bibliography:ObjectType-Article-1
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ISSN:2352-3409
2352-3409
DOI:10.1016/j.dib.2021.107049