In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach

<i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agricu...
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Autor*in:	Mohammed Ageeli Hakami [verfasserIn] Nosheen Malak [verfasserIn] Afshan Khan [verfasserIn] Hidayat Ullah [verfasserIn] Raquel Cossío-Bayúgar [verfasserIn] Nasreen Nasreen [verfasserIn] Sadaf Niaz [verfasserIn] Adil Khan [verfasserIn] Chien-Chin Chen [verfasserIn]

Format:	E-Artikel
Sprache:	Englisch

Erschienen:	2023

Schlagwörter:	molecular docking plant extract

Übergeordnetes Werk:	In: Life - MDPI AG, 2012, 13(2023), 2040, p 2040
Übergeordnetes Werk:	volume:13 ; year:2023 ; number:2040, p 2040

Links:	Link aufrufen Link aufrufen Link aufrufen Journal toc

DOI / URN:	10.3390/life13102040

Katalog-ID:	DOAJ093116667

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allfields	10.3390/life13102040 doi (DE-627)DOAJ093116667 (DE-599)DOAJa2a6861e980946f2ab2814993e088a4a DE-627 ger DE-627 rakwb eng Mohammed Ageeli Hakami verfasserin aut In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach 2023 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier <i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals. <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q Nosheen Malak verfasserin aut Afshan Khan verfasserin aut Hidayat Ullah verfasserin aut Raquel Cossío-Bayúgar verfasserin aut Nasreen Nasreen verfasserin aut Sadaf Niaz verfasserin aut Adil Khan verfasserin aut Chien-Chin Chen verfasserin aut In Life MDPI AG, 2012 13(2023), 2040, p 2040 (DE-627)718627156 (DE-600)2662250-6 20751729 nnns volume:13 year:2023 number:2040, p 2040 https://doi.org/10.3390/life13102040 kostenfrei https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a kostenfrei https://www.mdpi.com/2075-1729/13/10/2040 kostenfrei https://doaj.org/toc/2075-1729 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_206 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_602 GBV_ILN_2005 GBV_ILN_2009 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2055 GBV_ILN_2111 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 13 2023 2040, p 2040
spelling	10.3390/life13102040 doi (DE-627)DOAJ093116667 (DE-599)DOAJa2a6861e980946f2ab2814993e088a4a DE-627 ger DE-627 rakwb eng Mohammed Ageeli Hakami verfasserin aut In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach 2023 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier <i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals. <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q Nosheen Malak verfasserin aut Afshan Khan verfasserin aut Hidayat Ullah verfasserin aut Raquel Cossío-Bayúgar verfasserin aut Nasreen Nasreen verfasserin aut Sadaf Niaz verfasserin aut Adil Khan verfasserin aut Chien-Chin Chen verfasserin aut In Life MDPI AG, 2012 13(2023), 2040, p 2040 (DE-627)718627156 (DE-600)2662250-6 20751729 nnns volume:13 year:2023 number:2040, p 2040 https://doi.org/10.3390/life13102040 kostenfrei https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a kostenfrei https://www.mdpi.com/2075-1729/13/10/2040 kostenfrei https://doaj.org/toc/2075-1729 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_206 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_602 GBV_ILN_2005 GBV_ILN_2009 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2055 GBV_ILN_2111 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 13 2023 2040, p 2040
allfields_unstemmed	10.3390/life13102040 doi (DE-627)DOAJ093116667 (DE-599)DOAJa2a6861e980946f2ab2814993e088a4a DE-627 ger DE-627 rakwb eng Mohammed Ageeli Hakami verfasserin aut In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach 2023 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier <i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals. <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q Nosheen Malak verfasserin aut Afshan Khan verfasserin aut Hidayat Ullah verfasserin aut Raquel Cossío-Bayúgar verfasserin aut Nasreen Nasreen verfasserin aut Sadaf Niaz verfasserin aut Adil Khan verfasserin aut Chien-Chin Chen verfasserin aut In Life MDPI AG, 2012 13(2023), 2040, p 2040 (DE-627)718627156 (DE-600)2662250-6 20751729 nnns volume:13 year:2023 number:2040, p 2040 https://doi.org/10.3390/life13102040 kostenfrei https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a kostenfrei https://www.mdpi.com/2075-1729/13/10/2040 kostenfrei https://doaj.org/toc/2075-1729 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_206 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_602 GBV_ILN_2005 GBV_ILN_2009 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2055 GBV_ILN_2111 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 13 2023 2040, p 2040
allfieldsGer	10.3390/life13102040 doi (DE-627)DOAJ093116667 (DE-599)DOAJa2a6861e980946f2ab2814993e088a4a DE-627 ger DE-627 rakwb eng Mohammed Ageeli Hakami verfasserin aut In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach 2023 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier <i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals. <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q Nosheen Malak verfasserin aut Afshan Khan verfasserin aut Hidayat Ullah verfasserin aut Raquel Cossío-Bayúgar verfasserin aut Nasreen Nasreen verfasserin aut Sadaf Niaz verfasserin aut Adil Khan verfasserin aut Chien-Chin Chen verfasserin aut In Life MDPI AG, 2012 13(2023), 2040, p 2040 (DE-627)718627156 (DE-600)2662250-6 20751729 nnns volume:13 year:2023 number:2040, p 2040 https://doi.org/10.3390/life13102040 kostenfrei https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a kostenfrei https://www.mdpi.com/2075-1729/13/10/2040 kostenfrei https://doaj.org/toc/2075-1729 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_206 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_602 GBV_ILN_2005 GBV_ILN_2009 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2055 GBV_ILN_2111 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 13 2023 2040, p 2040
allfieldsSound	10.3390/life13102040 doi (DE-627)DOAJ093116667 (DE-599)DOAJa2a6861e980946f2ab2814993e088a4a DE-627 ger DE-627 rakwb eng Mohammed Ageeli Hakami verfasserin aut In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach 2023 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier <i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals. <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q Nosheen Malak verfasserin aut Afshan Khan verfasserin aut Hidayat Ullah verfasserin aut Raquel Cossío-Bayúgar verfasserin aut Nasreen Nasreen verfasserin aut Sadaf Niaz verfasserin aut Adil Khan verfasserin aut Chien-Chin Chen verfasserin aut In Life MDPI AG, 2012 13(2023), 2040, p 2040 (DE-627)718627156 (DE-600)2662250-6 20751729 nnns volume:13 year:2023 number:2040, p 2040 https://doi.org/10.3390/life13102040 kostenfrei https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a kostenfrei https://www.mdpi.com/2075-1729/13/10/2040 kostenfrei https://doaj.org/toc/2075-1729 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_206 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_602 GBV_ILN_2005 GBV_ILN_2009 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2055 GBV_ILN_2111 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 13 2023 2040, p 2040
language	English
source	In Life 13(2023), 2040, p 2040 volume:13 year:2023 number:2040, p 2040
sourceStr	In Life 13(2023), 2040, p 2040 volume:13 year:2023 number:2040, p 2040
format_phy_str_mv	Article
institution	findex.gbv.de
topic_facet	<i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i< Science Q
isfreeaccess_bool	true
container_title	Life
authorswithroles_txt_mv	Mohammed Ageeli Hakami @@aut@@ Nosheen Malak @@aut@@ Afshan Khan @@aut@@ Hidayat Ullah @@aut@@ Raquel Cossío-Bayúgar @@aut@@ Nasreen Nasreen @@aut@@ Sadaf Niaz @@aut@@ Adil Khan @@aut@@ Chien-Chin Chen @@aut@@
publishDateDaySort_date	2023-01-01T00:00:00Z
hierarchy_top_id	718627156
id	DOAJ093116667
language_de	englisch
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author	Mohammed Ageeli Hakami
spellingShingle	Mohammed Ageeli Hakami misc <i<Sarcoptes scabiei</i< glutathione transferase misc <i<Rhipicephalus microplus</i< glutathione transferase misc molecular docking misc plant extract misc <i<Camellia sinensis</i< misc Science misc Q In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach
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topic_title	In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach <i<Sarcoptes scabiei</i< glutathione transferase <i<Rhipicephalus microplus</i< glutathione transferase molecular docking plant extract <i<Camellia sinensis</i<
topic	misc <i<Sarcoptes scabiei</i< glutathione transferase misc <i<Rhipicephalus microplus</i< glutathione transferase misc molecular docking misc plant extract misc <i<Camellia sinensis</i< misc Science misc Q
topic_unstemmed	misc <i<Sarcoptes scabiei</i< glutathione transferase misc <i<Rhipicephalus microplus</i< glutathione transferase misc molecular docking misc plant extract misc <i<Camellia sinensis</i< misc Science misc Q
topic_browse	misc <i<Sarcoptes scabiei</i< glutathione transferase misc <i<Rhipicephalus microplus</i< glutathione transferase misc molecular docking misc plant extract misc <i<Camellia sinensis</i< misc Science misc Q
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title	In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach
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title_full	In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach
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author_browse	Mohammed Ageeli Hakami Nosheen Malak Afshan Khan Hidayat Ullah Raquel Cossío-Bayúgar Nasreen Nasreen Sadaf Niaz Adil Khan Chien-Chin Chen
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author-letter	Mohammed Ageeli Hakami
doi_str_mv	10.3390/life13102040
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title_sort	in silico exploration and experimental validation of <i<camellia sinensis</i< extract against <i<rhipicephalus microplus</i< and <i<sarcoptes scabiei</i<: an integrated approach
title_auth	In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach
abstract	<i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals.
abstractGer	<i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals.
abstract_unstemmed	<i<Sarcoptes scabiei</i< is an ectoparasite of humans and animals that causes scabies. The <i<Rhipicephalus (Boophilus) microplus</i< is a blood-sucking ectoparasite that transmits various pathogens. These two parasites have caused great losses to a country’s dairy and agriculture sectors. The aim of this study was to determine the in vitro and in silico efficacy of <i<Camellia sinensis</i< plant extracts. Different concentrations of <i<C. sinensis</i< ethanolic plant extracts were prepared using the maceration method and were used against mites and ticks (in adult immersion test AIT and larval packet test LPT) to evaluate their in vitro acaricidal activity. Additionally, in silico molecular docking was performed to investigate the inhibitory interactions between the phytochemicals of the plant and <i<S. scabiei</i< and <i<R. microplus</i< glutathione transferase proteins (SsGST and RmGST). This study observed that the plant extract showed high efficacy in vitro against mites and different tick stages in adult immersion and larval packet tests. Additionally, the in silico study revealed a strong binding interaction between ellagic acid and SsGST protein, with a binding energy of −7.3 kcal/mol, with respect to permethrin (−6.7 kcal/mol), whereas quercetin and RmGST resulted in a docking score of −8.6 kcal/mol compared to deltamethrin (−8.2 kcal/mol). Overall, this study explored the potential of <i<C. sinensis</i< as a natural alternative for controlling tick and mite infestations and provided insights into the inhibitory mechanisms of its phytochemicals.
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title_short	In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach
url	https://doi.org/10.3390/life13102040 https://doaj.org/article/a2a6861e980946f2ab2814993e088a4a https://www.mdpi.com/2075-1729/13/10/2040 https://doaj.org/toc/2075-1729
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In Silico Exploration and Experimental Validation of <i<Camellia sinensis</i< Extract against <i<Rhipicephalus microplus</i< and <i<Sarcoptes scabiei</i<: An Integrated Approach

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