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1.
J Mol Model ; 30(9): 298, 2024 Aug 06.
Artículo en Inglés | MEDLINE | ID: mdl-39103652

RESUMEN

CONTEXT: This study explores the interaction between particles in microplastic semi-coke water slurry at the molecular level using molecular simulation methods, specifically DFT calculations and MD simulations. In addition, the experiment of slurry preparation was carried out to study the viscosity and stability of the slurry. The electrostatic potential analysis shows that the interaction between microplastics and dispersant molecules occurs on atoms with large electronegativity or oxygen-containing functional groups, and the energy gap of frontier molecular orbitals indicated that PVC interacts most easily with the dispersant (0.39 eV), followed by PS (1.08 eV) and PET (3.65 eV). In addition, it is also noted that due to the steric hindrance effect, the adsorption energy was opposite to the DFT calculation results: PET was - 213.338 kcal/mol (NNO) which was highest, followed by PS (- 107.603 kcal/mol, NNO), and PVC (NNO) was lowest which was - 94.808 kcal/mol. And RDF shows similar results, which the probability of water molecules in the PET system was the highest, followed by PS, and finally, PVC. The MD results are consistent with the viscosity and stability characterization results of the slurry which PET has the lowest viscosity of 87.3 mPa·s. Finally, this study provides new ideas for the treatment of microplastics and the improvement of the performance of semi-coke water slurry and reveals the interaction mechanism between microplastics and semi-coke water slurry. METHODS: All calculations were performed using Materials Studio (MS) version 2020 software, BIOVIA Corporation. The DFT calculation was carried out through the DMol3 module. The DFT calculations include electron density, electrostatics, orbitals, and population analysis. In DMol3 module, the GGA-PBE function was selected to consider gradient changes in density in the simulated calculation. The DFT-D correction was selected, and all electrons were calculated by DNP for accurate core potentials and the DNP file was 4.4. MD simulation was performed through the Forcite module. MD simulation mainly focuses on relative concentration distribution analysis, radial distribution function, and adsorption energy calculation. All molecular geometry optimizations are performed in the Forcite module. In the molecular dynamic part, all simulations used PCFF forcefield. The NVT ensemble was adopted and using the Nosé thermostat.

2.
Metabolites ; 13(12)2023 Dec 11.
Artículo en Inglés | MEDLINE | ID: mdl-38132877

RESUMEN

Hypertrophy development induced by the overexpression of SlbHLH22 (also called SlUPA-like) was susceptible to Xanthomonas in tomatoes. Transcriptome and metabolome analyses were performed on the hypertrophy leaves of a SlbHLH22-overexpressed line (OE) and wild type (WT) to investigate the molecular mechanism. Metabolome analysis revealed that six key metabolites were over-accumulated in the OE, including Acetylserine/O-Acetyl-L-serine, Glucono-1,5-lactone, Gluconate, 2-Oxoglutarate, and Loganate, implying that the OE plants increased salt or oxidant resistance under normal growth conditions. The RNA-seq analysis showed the changed expressions of downstream genes involved in high-energy consumption, photosynthesis, and transcription regulation in OE lines, and we hypothesized that these biological processes were related to the GTgamma subfamily of trihelix factors. The RT-PCR results showed that the expressions of the GTgamma genes in tomatoes, i.e., SlGT-7 and SlGT-36, were suppressed in the hypertrophy development. The expression of the GTgamma gene was downregulated by salinity, indicating a coordinated role of GTgamma in hypertrophy development and salt stress. Further research showed that both SlGT-7 and SlGT-36 were highly expressed in leaves and could be significantly induced by abscisic acid (ABA). The GTgamma protein had a putative phosphorylation site at S96. These results suggested GTgamma's role in hypertrophy development by increasing the salt resistance.

3.
ACS Appl Mater Interfaces ; 15(48): 56181-56191, 2023 Dec 06.
Artículo en Inglés | MEDLINE | ID: mdl-38010839

RESUMEN

Due to the flexibility and versatility of the layered crystal structure of layered double hydroxides (LDHs), they have shown great potential in various fields. However, LDH nanosheets (LDH-NSs) are easy to agglomerate, leading to the problem of accumulation, which hinders their further application. Accordingly, once LDHs are combined with solvent-free nanofluids (SFNs), the advantages of LDHs and SFNs could be combined to achieve an extraordinary performance. However, the stacked structure of traditional LDHs is not conducive to the exposure of hydroxyl functional groups, and hydroxyl sites are key to the conversion of LDHs to SFNs. Therefore, in this work, nanoflower-like LDHs (NFLs) with abundant exposed hydroxyl groups were prepared and combined with organic oligomers to achieve a solid-to-liquid transition. The formation mechanism of NFLs and the grafting mechanism of OS-PEA on their surface were identified. The prepared NFL-F3 still has good fluidity and dispersion stability in different solvents after storage for 100 days. The high-saturated grafting density on the surface of NFLs increased the steric hindrance effect of the nanoparticles, thereby improving the dispersion stability and reducing the viscosity of NFL-F3. Notably, the CO2 sorption performance of NFL-F3 is significantly improved, which is attributed to the voids between polymers, physical sorption, and good fluidity caused by high-saturation grafting on the surface of NFL-F3. Finally, by combining the sorption behavior and model fitting, it was confirmed that the physical effect was dominant in CO2 sorption by the NFL-F, which saved energy for the sorption-desorption process of its industrial application. Moreover, NFL-F3 has a good CO2/N2 separation performance and cycle stability. We envision that this general strategy will open up new insights into the construction of innovative low-viscosity LDH-based SFNs with high CO2 capacity and facilitate CO2/N2 selectivity and offer new directions for LDH utilizations.

4.
Plant Cell Rep ; 42(5): 921-937, 2023 May.
Artículo en Inglés | MEDLINE | ID: mdl-37010556

RESUMEN

KEY MESSAGE: Transcriptomic, physiological, and qRT-PCR analysis revealed the potential mechanism by which SlPRE2 regulates plant growth and stomatal size via multiple phytohormone pathways in tomato. Paclobutrazol resistance proteins (PREs) are atypical members of the basic/helix-loop-helix (bHLH) transcription factor family that regulate plant morphology, cell size, pigment metabolism and abiotic stress in response to different phytohormones. However, little is known about the network regulatory mechanisms of PREs in plant growth and development in tomato. In this study, the function and mechanism of SlPRE2 in tomato plant growth and development were investigated. The quantitative RT-PCR results showed that the expression of SlPRE2 was regulated by multiple phytohormones and abiotic stresses. It showed light-repressed expression during the photoperiod. The RNA-seq results revealed that SlPRE2 regulated many genes involved in photosynthesis, chlorophyll metabolism, phytohormone metabolism and signaling, and carbohydrate metabolism, suggesting the role of SlPRE2 in gibberellin, brassinosteroid, auxin, cytokinin, abscisic acid and salicylic acid regulated plant development processes. Moreover, SlPRE2 overexpression plants showed widely opened stomata in young leaves, and four genes involved in stomatal development showed altered expression. Overall, the results demonstrated the mechanism by which SlPRE2 regulates phytohormone and stress responses and revealed the function of SlPRE2 in stomatal development in tomato. These findings provide useful clues for understanding the molecular mechanisms of SlPRE2-regulated plant growth and development in tomato.


Asunto(s)
Reguladores del Crecimiento de las Plantas , Solanum lycopersicum , Reguladores del Crecimiento de las Plantas/metabolismo , Transcriptoma/genética , Solanum lycopersicum/genética , Perfilación de la Expresión Génica , Factores de Transcripción con Motivo Hélice-Asa-Hélice Básico/genética , Transducción de Señal/genética , Regulación de la Expresión Génica de las Plantas , Proteínas de Plantas/genética , Proteínas de Plantas/metabolismo
5.
ACS Omega ; 7(50): 47048-47055, 2022 Dec 20.
Artículo en Inglés | MEDLINE | ID: mdl-36570206

RESUMEN

Rice sheath blight (RSB) caused by Rhizoctonia solani is one of the most destructive diseases of rice (Oryza sativa). Although chemical fungicides are the most important control methods, their long-term unreasonable application has brought about problems such as environmental pollution, food risks, and non-target poisoning. Therefore, considering the extraction of fungistatic substances from plants may be an alternative in the future. In this study, we found that the Moutan cortex ethanol extract has excellent antifungal activity against R. solani, with a 100% inhibition rate at 1000 µg/mL, which aroused our great exploration interest. In-depth exploration found that the antifungal active ingredients of M. cortex were mainly concentrated in the petroleum ether extract of the M. cortex ethanol extract, which still maintained a 100% inhibition rate with 250 µg/mL, and its effective medium concentration (EC50) was 145.33 µg/mL against R. solani. Through the measurement of extracellular relative conductivity and OD260, the petroleum ether extract induced leakage of intracellular electrolytes and nucleic acids, indicating that the cell membrane was ruined. Therefore, we preliminarily determined that the cell membrane may be the target of the petroleum ether extract. Moreover, we found that petroleum ether extract reduced the content of ergosterol, a component of the cell membrane, which may be one of the reasons for the cell membrane destruction. Furthermore, the increase of MDA content would lead to membrane lipid peroxidation, further aggravating membrane damage, resulting in increased membrane permeability. Also, the destruction of the cell membrane was observed by the phenomenon of the mycelium being transparent and broken. In conclusion, this is the first report of the M. cortex petroleum ether extract exhibiting excellent antifungal activity against R. solani. The effect of the M. cortex petroleum ether extract on R. solani may be on the cell membrane, inducing the disorder of intracellular substances and metabolism, which may be one of the antifungal mechanisms against R. solani.

6.
Plant Signal Behav ; 17(1): 2021649, 2022 12 31.
Artículo en Inglés | MEDLINE | ID: mdl-35007450

RESUMEN

WD40 repeat proteins, the homologs of yeast MSI1, are conserved in plants, participating in protein complexes and playing fundamental functions in plant development. Although several MSI1-like proteins have been cloned and characterized in plants, the roles of MSI1-like proteins in the biennial ornamental plant, Dendrobium nobile Lindl, are still unclear. Here, we report the cloning of the DnMSI1 gene from Dendrobium nobile Lindl with RACE technology. We found that DnMSI1 expression was induced by GA3 and TDZ but inhibited by ABA, PP333, and drought and salt stress. Furthermore, DnMSI1 over-expression in Arabidopsis resulted in decreased tolerance to NaCl stress. These results suggest that DnMSI1 plays negative regulation roles in regulating salinity-stress resistance in Dendrobium nobile Lindl.


Asunto(s)
Dendrobium , Clonación Molecular , Dendrobium/genética
7.
Plant Physiol Biochem ; 118: 235-244, 2017 Sep.
Artículo en Inglés | MEDLINE | ID: mdl-28649000

RESUMEN

MADS-box genes encode important transcription factors that are involved in many biological processes of plants, including fruit ripening. In our research, a MADS-box gene, SlMBP8, was identified, and its tissue-specific expression profiles were analysed. SlMBP8 was highly expressed in fruits of the B+4 stage, in senescent leaves and in sepals. To further characterize its function, an RNA interference (RNAi) expression vector of SlMBP8 was constructed and transferred into tomato. In the transgenic plants, the ripening of fruits was shortened by 2-4 days compared to that of wild type. At the same time, carotenoids accumulated to higher levels and the expression of phytone synthase 1 (PSY1), phytoene desaturase (PDS) and ς-carotene desaturase (ZDS) was enhanced in RNAi fruits. The transgenic fruits and seedlings showed more ethylene production compared with that of the wild type. Furthermore, SlMBP8-silenced seedlings displayed shorter hypocotyls due to higher endogenous ethylene levels, suggesting that SlMBP8 may modulates the ethylene triple response negatively. A yeast two-hybrid assay indicated that SlMBP8 could interact with SlMADS-RIN. Besides, the expression of ethylene-related genes, including ACO1, ACO3, ACS2, ERF1, E4 and E8, was simultaneously up-regulated in transgenic plants. In addition, SlMBP8-silenced fruits showed higher ethylene production, suggesting that suppressed expression of SlMBP8 promotes carotenoid and ethylene biosynthesis. In addition, the fruits of transgenic plants displayed more rapid water loss and decreased storability compared to wild type, which was due to the significantly induced expressions of cell wall metabolism genes such as PG, EXP, HEX, TBG4, XTH5 and XYL. These results suggest that SlMBP8 plays an important role in fruit ripening and softening.


Asunto(s)
Frutas/metabolismo , Regulación de la Expresión Génica de las Plantas , Proteínas de Dominio MADS/genética , Proteínas de Dominio MADS/metabolismo , Proteínas de Plantas/biosíntesis , Plantones/metabolismo , Solanum lycopersicum/metabolismo , Frutas/genética , Silenciador del Gen , Solanum lycopersicum/genética , Proteínas de Plantas/genética , Plantas Modificadas Genéticamente/genética , Plantas Modificadas Genéticamente/metabolismo , Plantones/genética
8.
Plant Physiol Biochem ; 103: 183-90, 2016 Jun.
Artículo en Inglés | MEDLINE | ID: mdl-26995313

RESUMEN

Lablab pods, as dietary vegetable, have high nutritional values similar to most of edible legumes. Moreover, our studies confirmed that purple lablab pods contain the natural pigments of anthocyanins and flavonols. Compared to green pods, five kinds of anthocyanins (malvidin, delphinidin and petunidin derivatives) were found in purple pods by HPLC-ESI-MS/MS and the major contents were delphinidin derivatives. Besides, nine kinds of polyphenol derivatives (quercetin, myricetin, kaempferol and apigenin derivatives) were detected by UPLC-ESI-MS/MS and the major components were quercetin and myricetin derivatives. In order to discover their molecular mechanism, expression patterns of biosynthesis and regulatory gens of anthocyanins and flavonols were investigated. Experimental results showed that LpPAL, LpF3H, LpF3'H, LpDFR, LpANS and LpPAP1 expressions were significantly induced in purple pods compared to green ones. Meanwhile, transcripts of LpFLS were more abundant in purple pods than green or yellow ones, suggestind that co-pigments of anthocyanins and flavonols are accumulated in purple pods. Under continuously dark condition, no anthocyanin accumulation was detected in purple pods and transcripts of LpCHS, LpANS, LpFLS and LpPAP1 were remarkably repressed, indicating that anthocyanins and flavonols biosynthesis in purple pods was regulated in light-dependent manner. These results indicate that co-pigments of anthocyanins and flavonols contribute to purple pigmentations of pods.


Asunto(s)
Antocianinas/metabolismo , Antioxidantes/metabolismo , Fabaceae/fisiología , Flavonoles/metabolismo , Antocianinas/análisis , Antioxidantes/análisis , Color , Fabaceae/química , Fabaceae/genética , Fabaceae/efectos de la radiación , Flavonoides/análisis , Flavonoides/metabolismo , Flavonoles/análisis , Frutas/química , Frutas/genética , Frutas/fisiología , Luz , Pigmentación , Polifenoles/análisis , Polifenoles/metabolismo , Espectrometría de Masas en Tándem
9.
Sci Rep ; 6: 23818, 2016 Mar 30.
Artículo en Inglés | MEDLINE | ID: mdl-27025226

RESUMEN

upa20 induces cell enlargement and hypertrophy development. In our research, overexpression of SlUPA-like, orthologous to upa20, severely affected the growth of vegetative and reproductive tissues. Wilted leaves curled upwardly and sterile flowers were found in transgenic lines. Through anatomical analysis, palisade and spongy tissues showed fluffy and hypertrophic development in transgenic plants. Gene expression analysis showed that GA responsive, biosynthetic and signal transduction genes (e.g. GAST1, SlGA20OXs, SlGA3OXs, SlGID1s, and SlPREs) were significantly upregulated, indicating that GA response is stimulated by overproduction of SlUPA-like. Furthermore, SlUPA-like was strongly induced by exogenous JA and wounding. Decreased expression of PI-I and induced expression of SlJAZs (including SlJAZ2, SlJAZ10 and SlJAZ11) were observed in transgenic plants, suggesting that JA response is repressed. In addition, SlUPA-like overexpressed plant exhibited more opened stoma and higher water loss than the control when treated with dehydration stress, which was related to decreased ABA biosynthesis, signal transduction and response. Particularly, abnormal developments of transgenic plants promote the plant susceptibility to Xanthomonas campestris pv. campestris. Therefore, it is deduced from these results that SlUPA-like plays vital role in regulation of plant development and stress tolerance through GA, JA and ABA pathways.


Asunto(s)
Reguladores del Crecimiento de las Plantas/fisiología , Proteínas de Plantas/genética , Solanum lycopersicum/citología , Factores de Transcripción/genética , Aumento de la Célula , Deshidratación/metabolismo , Resistencia a la Enfermedad , Expresión Génica , Ácidos Linoleicos/fisiología , Solanum lycopersicum/crecimiento & desarrollo , Solanum lycopersicum/metabolismo , Enfermedades de las Plantas , Proteínas de Plantas/metabolismo , Estomas de Plantas/citología , Estomas de Plantas/crecimiento & desarrollo , Estomas de Plantas/metabolismo , Transducción de Señal , Estrés Fisiológico , Factores de Transcripción/metabolismo
10.
Plant Physiol Biochem ; 97: 304-12, 2015 Dec.
Artículo en Inglés | MEDLINE | ID: mdl-26512970

RESUMEN

Kidney bean (Phaseolus vulgaris L.) is an important dietary legume crop cultivated and consumed worldwide. A purple cultivar (Zi Bawang) and a green cultivar (Chun Qiu), the main difference of which is in the pod skin color, were selected for the study. Malvidin 3, 5-diglucoside is identified as the major anthocyanin in the pod skin of Zi Bawang by HPLC-ESI-MS/MS. Three regulatory genes PvMYB1, PvMYB2, PvTT8-1 and most structural genes are dramatically up-regulated in purple pod skin compared to those in other materials. Significantly decreased expression levels of all regulatory genes and most biosynthetic genes are also detected in the purple skin of pods covered with bags compared to non-covered ones. All the results suggest that PvMYB1, PvMYB2 and PvTT8-1 might play a critical role in transcriptional activation of most anthocyanin biosynthetic genes in purple kidney bean pod.


Asunto(s)
Antocianinas/metabolismo , Vías Biosintéticas/genética , Regulación de la Expresión Génica de las Plantas , Genes de Plantas , Phaseolus/genética , Antocianinas/química , Vías Biosintéticas/efectos de la radiación , Cromatografía Líquida de Alta Presión , Regulación de la Expresión Génica de las Plantas/efectos de la radiación , Luz , Fenotipo , Espectrometría de Masa por Ionización de Electrospray
11.
Sci Rep ; 4: 4367, 2014 Mar 13.
Artículo en Inglés | MEDLINE | ID: mdl-24621662

RESUMEN

MADS-domain proteins are important transcription factors involved in many biological processes of plants. In our study, a tomato MADS-box gene, SlFYFL, was isolated. SlFYFL is expressed in all tissues of tomato and significantly higher in mature leave, fruit of different stages, AZ (abscission zone) and sepal. Delayed leaf senescence and fruit ripening, increased storability and longer sepals were observed in 35S:FYFL tomato. The accumulation of carotenoid was reduced, and ethylene content, ethylene biosynthetic and responsive genes were down-regulated in 35S:FYFL fruits. Abscission zone (AZ) did not form normally and abscission zone development related genes were declined in AZs of 35S:FYFL plants. Yeast two-hybrid assay revealed that SlFYFL protein could interact with SlMADS-RIN, SlMADS1 and SlJOINTLESS, respectively. These results suggest that overexpression of SlFYFL regulate fruit ripening and development of AZ via interactions with the ripening and abscission zone-related MADS box proteins.


Asunto(s)
Envejecimiento/genética , Flores/fisiología , Frutas/fisiología , Proteínas de Dominio MADS/genética , Solanum lycopersicum/genética , Secuencia de Aminoácidos , Carotenoides/biosíntesis , Etilenos/biosíntesis , Flores/metabolismo , Frutas/metabolismo , Regulación de la Expresión Génica de las Plantas , Solanum lycopersicum/metabolismo , Proteínas de Dominio MADS/biosíntesis , Datos de Secuencia Molecular , Hojas de la Planta/metabolismo , Proteínas de Plantas/genética , Plantas Modificadas Genéticamente/genética , Alineación de Secuencia
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