Data on the docking of phytoconstituents of betel plant and matcha green tea on SARS-CoV-2
© 2021 The Authors. Published by Elsevier Inc..
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.
| Medienart: |
E-Artikel |
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| Erscheinungsjahr: |
2021 |
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| Erschienen: |
2021 |
| Enthalten in: |
Zur Gesamtaufnahme - volume:36 |
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| Enthalten in: |
Data in brief - 36(2021) vom: 11. Juni, Seite 107049 |
| Sprache: |
Englisch |
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| Beteiligte Personen: |
Fatimawali [VerfasserIn] |
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| Links: |
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| Themen: |
Antiviral |
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| Anmerkungen: |
Date Revised 11.05.2021 published: Print-Electronic Citation Status PubMed-not-MEDLINE |
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| doi: |
10.1016/j.dib.2021.107049 |
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| Förderinstitution / Projekttitel: |
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| PPN (Katalog-ID): |
NLM324243596 |
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| 520 | |a © 2021 The Authors. Published by Elsevier Inc. | ||
| 520 | |a 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 | ||
| 650 | 4 | |a Journal Article | |
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| 650 | 4 | |a Docking | |
| 650 | 4 | |a In silico | |
| 650 | 4 | |a Matcha green tea | |
| 650 | 4 | |a Phytoconstituent | |
| 650 | 4 | |a SARS-CoV-2 | |
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| 700 | 1 | |a Windah, Axl Laurens Lukas |e verfasserin |4 aut | |
| 700 | 1 | |a Wahongan, Irma Febrianti |e verfasserin |4 aut | |
| 700 | 1 | |a Tumilaar, Sefren Geiner |e verfasserin |4 aut | |
| 700 | 1 | |a Adam, Ahmad Akroman |e verfasserin |4 aut | |
| 700 | 1 | |a Kepel, Billy Johnson |e verfasserin |4 aut | |
| 700 | 1 | |a Bodhi, Widdhi |e verfasserin |4 aut | |
| 700 | 1 | |a Tallei, Trina Ekawati |e verfasserin |4 aut | |
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