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1.
J Mol Model ; 29(12): 375, 2023 Nov 15.
Artigo em Inglês | MEDLINE | ID: mdl-37964098

RESUMO

CONTEXT: The efficient catalysis of CO2 adsorption and activation presents a formidable challenge due to its pronounced thermodynamic stability and kinetic inertia. Previous experiments have left gaps in understanding the promotional effects and underlying mechanism of potassium. In this study, we systematically investigate CO2 adsorption and activation on clean and potassium-preadsorbed low index surfaces of transition metals. Theoretical results reveal a substantial augmentation in CO2 binding strength when potassium is introduced, concomitant with a general reduction in activation energies. Notably, linear correlations are significant on close-packed metal surfaces without and with potassium additive. Through a comprehensive analysis encompassing geometric parameters, electronic structures, and energy decomposition, we discern the physical underpinnings of the potassium effect. This enhancement is primarily ascribed to direct electron transfer and dipole-dipole interactions. Furthermore, we scrutinize the impact of an external electric field, demonstrating that the application of a negative electric field accelerates CO2 activation, mirroring the effects observed with potassium. METHODS: All the periodic density function theory (DFT) calculations were performed by the Vienna Ab Initio Simulation package (VASP). The interaction between nucleus and valence electron was described using the pseudopotentials found in the projector augmented wave method (PAW). Throughout the entire work, the Bayesian error estimation functional (BEEF) was used.

2.
Plant Sci ; 268: 1-10, 2018 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-29362078

RESUMO

Accumulating evidence indicates that plant plastocyanin is involved in copper homeostasis, yet the physiological relevance remains elusive. In this study, we found that a plastocyanin gene (SsPETE2) from euhalophyte Suaeda salsa possessed a novel antioxidant function, which was associated with the copper-chelating activity of SsPETE2. In S. salsa, expression of SsPETE2 increased in response to oxidative stress and ectopic expression of SsPETE2 in Arabidopsis enhanced the antioxidant ability of the transgenic plants. SsPETE2 bound Cu ion and alleviated formation of hydroxyl radicals in vitro. Accordingly, SsPETE2 expression lowered the free Cu content that was associated with reduced H2O2 level under oxidative stress. Arabidopsis pete1 and pete2 mutants showed ROS-sensitive phenotypes that could be restored by expression of SsPETE2 or AtPETEs. In addition, SsPETE2-expressing plants exhibited more potent tolerance to oxidative stress than plants overexpressing AtPETEs, likely owing to the stronger copper-binding activity of SsPETE2 than AtPETEs. Taken together, these results demonstrated that plant PETEs play a novel role in oxidative stress tolerance by regulating Cu homeostasis under stress conditions, and SsPETE2, as an efficient copper-chelating PETE, potentially could be used in crop genetic engineering.


Assuntos
Adaptação Fisiológica , Chenopodiaceae/genética , Chenopodiaceae/fisiologia , Expressão Ectópica do Gene , Estresse Oxidativo/genética , Proteínas de Plantas/metabolismo , Plastocianina/genética , Adaptação Fisiológica/efeitos dos fármacos , Antioxidantes/metabolismo , Arabidopsis/genética , Arabidopsis/fisiologia , Quelantes/farmacologia , Chenopodiaceae/efeitos dos fármacos , Cloroplastos/efeitos dos fármacos , Cloroplastos/metabolismo , Cobre/farmacologia , Desoxirribose/metabolismo , Regulação da Expressão Gênica de Plantas/efeitos dos fármacos , Peróxido de Hidrogênio/metabolismo , Peróxido de Hidrogênio/farmacologia , Radical Hidroxila/metabolismo , Íons , Ferro/metabolismo , Simulação de Dinâmica Molecular , Mutação/genética , Estresse Oxidativo/efeitos dos fármacos , Paraquat/farmacologia , Fenótipo , Proteínas de Plantas/genética , Plantas Geneticamente Modificadas , Plastocianina/metabolismo , Transporte Proteico/efeitos dos fármacos
3.
Yi Chuan ; 34(2): 240-7, 2012 Feb.
Artigo em Chinês | MEDLINE | ID: mdl-22382066

RESUMO

Chitinase is one of the important pathogenesis-related (PR) proteins in plants. By comparative proteomics study, a novel pathogen-responsive chitinase (known as GbCHI) has been identified from sea-island cotton (Gossypium barbadense). The GbCHI cDNA was cloned from wilt-resistant sea-island cotton and the anti-fungal activity of the gene product was investigated. qRT-PCR analysis indicated that GbCHI was expressed constitutively in root, stem, leaf, flower, and ovule of cotton plant, and the expression could be induced by Verticillium dahliae and plant hormone SA, ACC, and JA. Subcellular localization analysis using GFP-tagged proteins showed that GbCHI-GFP fusion proteins were targeted mainly to the plasma membrane. Anti-fungal assay demonstrated that GbCHI could inhibit spore germination and hyphae growth of V. dahliae significantly. These results provide important information for understanding the cellular function of GbCHI and for exploring the application potential of this gene in molecular breeding of wilt-tolerant cotton plants.


Assuntos
Quitinases/genética , Gossypium/genética , Sequência de Aminoácidos , Antifúngicos/farmacologia , Quitinases/química , Quitinases/farmacologia , Clonagem Molecular , Dados de Sequência Molecular , Proteômica , Verticillium/efeitos dos fármacos
4.
Neurosci Bull ; 27(6): 407-12, 2011 Dec.
Artigo em Inglês | MEDLINE | ID: mdl-22108817

RESUMO

Galanin is a neuropeptide widely expressed in the brain. It is implicated in energy expenditure, feeding, and the regulation of body weight. Numerous studies have revealed that galanin regulates food intake via galanin receptors, 5-HT(1A) receptor and adrenergic α-2 receptor. In this review, we summarize recent findings that reveal the essential role of galanin in increasing food intake as well as body weight and that identify the individual galanin receptor subtypes involved in the brain's modulation of food intake and energy expenditure, to provide a theoretical basis for further studies of different aspects of galanin action.


Assuntos
Comportamento Alimentar , Galanina/fisiologia , Animais , Sistema Nervoso Central/efeitos dos fármacos , Sistema Nervoso Central/fisiologia , Ingestão de Alimentos/fisiologia , Metabolismo Energético/fisiologia , Comportamento Alimentar/efeitos dos fármacos , Galanina/metabolismo , Galanina/farmacologia , Humanos , Camundongos , Receptor 5-HT1A de Serotonina/metabolismo , Receptores Adrenérgicos alfa 2/metabolismo , Receptores de Galanina/metabolismo
5.
Proteomics ; 11(22): 4296-309, 2011 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-21928292

RESUMO

Verticillium wilt of cotton is a vascular disease mainly caused by the soil-born filamentous fungus Verticillium dahliae. To study the mechanisms associated with defense responses in wilt-resistant sea-island cotton (Gossypium barbadense) upon V. dahliae infection, a comparative proteomic analysis between infected and mock-inoculated roots of G. barbadense var. Hai 7124 (a cultivar showing resistance against V. dahliae) was performed by 2-DE combined with local EST database-assisted PMF and MS/MS analysis. A total of 51 upregulated and 17 downregulated proteins were identified, and these proteins are mainly involved in defense and stress responses, primary and secondary metabolisms, lipid transport, and cytoskeleton organization. Three novel clues regarding wilt resistance of G. barbadense are gained from this study. First, ethylene signaling was significantly activated in the cotton roots attacked by V. dahliae as shown by the elevated expression of ethylene biosynthesis and signaling components. Second, the Bet v 1 family proteins may play an important role in the defense reaction against Verticillium wilt. Third, wilt resistance may implicate the redirection of carbohydrate flux from glycolysis to pentose phosphate pathway (PPP). To our knowledge, this study is the first root proteomic analysis on cotton wilt resistance and provides important insights for establishing strategies to control this disease.


Assuntos
Gossypium/metabolismo , Gossypium/microbiologia , Doenças das Plantas/microbiologia , Proteínas de Plantas/metabolismo , Verticillium/metabolismo , Western Blotting , Eletroforese em Gel Bidimensional , Espectrometria de Massas , Raízes de Plantas/metabolismo , Proteoma/química , Proteoma/metabolismo , Proteômica , Estresse Fisiológico/fisiologia
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