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1.
Int J Parasitol Parasites Wildl ; 25: 100996, 2024 Dec.
Artículo en Inglés | MEDLINE | ID: mdl-39380748

RESUMEN

Osteocephalus cabrerai is an arboreal anuran widely distributed in South America. However, there are no parasitological studies conducted on the species, resulting in a parasite fauna completely unknown. Thus, this study aims to characterize the parasitic community structure of O. cabrerai in the municipality of Pedra Branca do Amapari, Amapá state, Amazon region, Brazil. We collected and necropsied 84 specimens of O. cabrerai to search for helminths. Parasite community structure was analyzed using helminth parasite richness, diversity, and abundance. The helminth component community of O. cabrerai comprises six nematode species: Cosmocerca parva, Cosmocerca podicipinus, Oxyascaris oxyascaris, Oswaldocruzia chabaudi, and Physaloptera sp. (larvae). Most helminth species represent the first record for the genus Osteocephalus, except Physaloptera sp. The helminth infections in the host showed a typical aggregated distribution pattern for parasites. We only found a positive correlation between the host weight and total intensity. Our bibliography revision reinforces the need for further studies on the helminth fauna of Osteocephalus spp.

2.
Parasitology ; : 1-16, 2024 Oct 02.
Artículo en Inglés | MEDLINE | ID: mdl-39355947

RESUMEN

Schrankiana are gastrointestinal parasites of anurans, distributed throughout Central and South America. Schrankiana formosula and Schrankiana inconspicata are some of the most commonly reported species parasitising anurans from Brazil, and the morphological differences between them are unclear. In the present study, we redescribed S. formosula based on a re-examination of type series and newly collected material from the frog Leptodactylus pentadactylus in the state of Amapá, Brazil. Additionally, we re-examined the type series of S. inconspicata, and propose it as a junior synonym of S. formosula. We provide detailed morphological and morphometric data with intraspecific variation analyses and new molecular data for S. formosula. In the present phylogeny, S. formosula formed a well-supported clade with Raillietnema sp. and Labeonema synodontisi. Based on molecular phylogenetic analyses and some morphological similarities, our findings support the hypothesis that Schrankiana is a member of the family Cosmocercidae, not Atractidae. Additionally, we provide the first ultrastructural descriptions of S. formosula, and establish the species' phylogenetic position from the Cosmocercidae.

3.
Molecules ; 29(19)2024 Sep 29.
Artículo en Inglés | MEDLINE | ID: mdl-39407546

RESUMEN

This study characterized the binding mechanisms of the lectin cMoL (from Moringa oleifera seeds) to carbohydrates using spectroscopy and molecular dynamics (MD). The interaction with carbohydrates was studied by evaluating lectin fluorescence emission after titration with glucose or galactose (2.0-11 mM). The Stern-Volmer constant (Ksv), binding constant (Ka), Gibbs free energy (∆G), and Hill coefficient were calculated. After the urea-induced denaturation of cMoL, evaluations were performed using fluorescence spectroscopy, circular dichroism (CD), and hemagglutinating activity (HA) evaluations. The MD simulations were performed using the Amber 20 package. The decrease in Ksv revealed that cMoL interacts with carbohydrates via a static mechanism. The cMoL bound carbohydrates spontaneously (ΔG < 0) and presented a Ka on the order of 102, with high selectivity for glucose. Protein-ligand complexes were stabilized by hydrogen bonds and hydrophobic interactions. The Hill parameter (h~2) indicated that the binding occurs through the cMoL dimer. The loss of HA at urea concentrations at which the fluorescence and CD spectra indicated protein monomerization confirmed these results. The MD simulations revealed that glucose bound to the large cavity formed between the monomers. In conclusion, the biotechnological application of cMoL lectin requires specific methods or media to improve its dimeric protein structure.


Asunto(s)
Simulación de Dinámica Molecular , Moringa oleifera , Unión Proteica , Semillas , Moringa oleifera/química , Semillas/química , Lectinas de Plantas/química , Multimerización de Proteína , Carbohidratos/química , Dicroismo Circular , Lectinas/química , Lectinas/metabolismo , Espectrometría de Fluorescencia , Conformación Proteica , Termodinámica , Enlace de Hidrógeno
4.
J Oleo Sci ; 73(8): 1091-1104, 2024.
Artículo en Inglés | MEDLINE | ID: mdl-39085083

RESUMEN

The Bauhinia ungulata, also known by its common name "pata de vaca", is one of the species used in Brazil for medicinal purposes, and is commonly used for the treatment of diabetes. In this study, the authors studied the interaction between the chemical constituents which are present in the essential oil of Bauhinia ungulata (EOBU), collected in Boa Vista-RR, Legal Amazon, and their effects on the enzyme acetylcholinesterase (AChE) in the essential oil. The analysis that we perform includes proton magnetic resonance ( 1H NMR), enzymatic inhibition, molecular docking, in silico toxicity prediction, enrichment analysis, and target prediction for biological interactions. According to the tests performed on the essential oil, it obtained 100% inhibition of the enzyme AChE. During 1H NMR experiments, it was found that α- Bisabolol, one of the main components, had a significant alteration in its chemical shift. A molecular docking analysis confirmed that this compound binds to the AChE enzyme, which confirms the 1H NMR analysis. The results of this work showed that the major component of EOBU acted as a possible inhibitor of AChE enzyme in vitro and in silico assays. These results show that EOBU could be potentially applied in Alzheimer's disease treatment.


Asunto(s)
Acetilcolinesterasa , Bauhinia , Inhibidores de la Colinesterasa , Simulación del Acoplamiento Molecular , Aceites Volátiles , Inhibidores de la Colinesterasa/farmacología , Inhibidores de la Colinesterasa/química , Bauhinia/química , Brasil , Acetilcolinesterasa/metabolismo , Aceites Volátiles/química , Aceites Volátiles/farmacología , Simulación por Computador , Sesquiterpenos/farmacología , Sesquiterpenos/aislamiento & purificación , Sesquiterpenos/química
5.
Int J Parasitol Parasites Wildl ; 24: 100930, 2024 Aug.
Artículo en Inglés | MEDLINE | ID: mdl-38680472

RESUMEN

Ophiotaenia is the most diverse genus among proteocephalids, composed of species commonly found parasitizing snakes worldwide. However, the diversity of Ophiotaenia in the Neotropical region is still underestimated. This study describes Ophiotaenia karipuna n. sp. found parasitizing Erythrolamprus miliaris in the State of Amapá, Brazil. Additionally, we redescribe Ophiotaenia arandasi based on a re-examination of type series and newly collected material from Erythrolamprus taeniogaster in the State of Pará, Brazil. The new species differs from its congeners in the following characteristics: scolex width, number of testes, relative length of the cirrus-sac, absence of a vaginal sphincter, presence of a vestigial apical organ resembling a sucker, and relative size of the ovary in relation to the surface of the proglottid. Furthermore, we provide taxonomic information for Ophiotaenia arandasi not reported in the original description, including morphology of embryophore, uterine development, and the absence of the vaginal sphincter in the species. Ophiotaenia karipuna n. sp. represents the 21st- species described in snakes -from the Neotropical region and the first formally described in the Brazilian Amazon. Additionally, we provide the first ultrastructural analysis, a new host, and locality records for O. arandasi.

6.
Spectrochim Acta A Mol Biomol Spectrosc ; 314: 124176, 2024 Jun 05.
Artículo en Inglés | MEDLINE | ID: mdl-38513314

RESUMEN

Here, we presented a second-order scattering sensor based on the Zn0.97La0.03O compound (LaZnO) for selective and stable detection of glycated albumin (GA, glycemic long-term biomarker). The LaZnO sample was obtained through the co-precipitation method and then characterized using microscopic and spectroscopic techniques. Furthermore, the selectivity, molecular interference, temporal stability, and pH effects of the LaZnO SOS signal in the absence and presence of GA were investigated. The results indicate the stability of the SOS signal over more than 60 days. Assays conducted within the pH range of 5 to 8 indicate that the detection of GA remains unaffected under the given conditions. Selectivity studies show that the SOS signal of LaZnO is reduced only upon contact with GA, while interference studies show that detection is not affected by other chemical species. Additionally, the calibration curve test showed high sensitivity of the material, with a detection limit of 0.55 µg/ml. All the results suggest that LaZnO can deliver efficiency, selectivity, accuracy, and fast response as a GA biosensor, emphasizing LaZnO's usefulness in detecting protein biomarkers.


Asunto(s)
Albúmina Sérica Glicada , Productos Finales de Glicación Avanzada , Albúmina Sérica/metabolismo , Biomarcadores , Zinc , Glucemia
7.
Mar Drugs ; 22(3)2024 Feb 29.
Artículo en Inglés | MEDLINE | ID: mdl-38535458

RESUMEN

The venom of cone snails has been proven to be a rich source of bioactive peptides that target a variety of ion channels and receptors. α-Conotoxins (αCtx) interact with nicotinic acetylcholine receptors (nAChRs) and are powerful tools for investigating the structure and function of the various nAChR subtypes. By studying how conotoxins interact with nAChRs, we can improve our understanding of these receptors, leading to new insights into neurological diseases associated with nAChRs. Here, we describe the discovery and characterization of a novel conotoxin from Conus ateralbus, αCtx-AtIA, which has an amino acid sequence homologous to the well-described αCtx-PeIA, but with a different selectivity profile towards nAChRs. We tested the synthetic αCtx-AtIA using the calcium imaging-based Constellation Pharmacology assay on mouse DRG neurons and found that αCtx-AtIA significantly inhibited ACh-induced calcium influx in the presence of an α7 positive allosteric modulator, PNU-120596 (PNU). However, αCtx-AtIA did not display any activity in the absence of PNU. These findings were further validated using two-electrode voltage clamp electrophysiology performed on oocytes overexpressing mouse α3ß4, α6/α3ß4 and α7 nAChRs subtypes. We observed that αCtx-AtIA displayed no or low potency in blocking α3ß4 and α6/α3ß4 receptors, respectively, but improved potency and selectivity to block α7 nAChRs when compared with αCtx-PeIA. Through the synthesis of two additional analogs of αCtx-AtIA and subsequent characterization using Constellation Pharmacology, we were able to identify residue Trp18 as a major contributor to the activity of the peptide.


Asunto(s)
Conotoxinas , Caracol Conus , Receptores Nicotínicos , Animales , Ratones , Calcio , Secuencia de Aminoácidos , Receptor Nicotínico de Acetilcolina alfa 7
8.
J Biomol Struct Dyn ; 42(2): 687-695, 2024.
Artículo en Inglés | MEDLINE | ID: mdl-36995305

RESUMEN

Metal encapsulation delivers a straightforward strategy to improve miscellaneous nanoparticle properties and qualifies the resulting nanocomposite for exceptional application, including bioimaging, drug release, and theranostic development. Besides crucial applications, investigations associated with the nanocomposite impact on the biological media are highly relevant from a pharmacological viewpoint. Such studies can be conducted by exploring nanocomposite attributes and all aspects of their interaction with proteins existing in biofluids. Based on these aspects, the present work examines manganese-encapsulated carbonaceous nanocomposite (MnCQD) and their interaction with plasma proteins. On one side, the obtained nanocomposite has almost spherical shapes (≈12 nm in size), an appropriate composition and interesting optical properties for bioimaging applications. On another side, MnCQD quenches the fluorescence of two plasma proteins (BSA and HTF) following a static mechanism, confirming the formation of the MnCQD-BSA and MnCQD-HTF complexes. Although hydrophobic forces guide the stability of both formed complexes, MnCQD binds preferentially to BSA compared to HTF, with affinity constants differing by almost an order of magnitude. Furthermore, HTF and BSA underwent modifications in their secondary structure provoked due to contact with the nanocomposite, which also presented neglectable opsonization levels when exposed to appropriate biological media. These results highlight the MnCQD outstanding potential to be employed in diverse bioapplications.Communicated by Ramaswamy H. Sarma.


Asunto(s)
Manganeso , Nanocompuestos , Opsonización , Fluorescencia , Proteínas Sanguíneas , Nanocompuestos/química , Albúmina Sérica Bovina/química , Unión Proteica , Espectrometría de Fluorescencia
9.
Mol Pharm ; 20(8): 4021-4030, 2023 08 07.
Artículo en Inglés | MEDLINE | ID: mdl-37382244

RESUMEN

The ability to bind plasma proteins helps in comprehending relevant aspects related to the pharmacological properties of many drugs. Despite the vital role of the drug mubritinib (MUB) in the prophylaxis of various diseases, its interaction with carrier proteins still needs to be clarified. The present work focuses on the interaction between MUB and Human serum albumin (HSA), investigated by employing multispectroscopic, biochemical, and molecular docking approaches. The results reveal that MUB has quenched HSA intrinsic fluorescence (following a static mechanism) by attaching very close (r = 6.76 Å) and with moderate affinity (Kb ≈ 104 M-1) to the protein site I (mainly by H-bonds, hydrophobic and Van der Waals forces). On one side, the HSA-MUB interaction has been accompanied by a slight disturbance in the HSA chemical environment (around the Trp residue) and protein secondary structure modifications. On another side, MUB competitively inhibits HSA esterase-like activity, which is very similar to other Tyrosine kinase inhibitors, and evidence that protein functional alterations have been triggered by MUB interaction. In summary, all of the presented observations can shed light on diverse pharmacological factors associated with drug administration.


Asunto(s)
Albúmina Sérica Humana , Humanos , Albúmina Sérica Humana/química , Simulación del Acoplamiento Molecular , Sitios de Unión , Unión Proteica , Transporte de Electrón , Espectrometría de Fluorescencia , Termodinámica , Dicroismo Circular
10.
Mar Drugs ; 20(12)2022 Dec 02.
Artículo en Inglés | MEDLINE | ID: mdl-36547908

RESUMEN

Nature-based and sustainably sourced cosmetics have been dominating the area of skincare products worldwide. Due to their antioxidant and antiaging properties, compounds from cyanobacteria, such as carotenoids and phycobiliproteins, may replace synthetic ingredients in cosmetic formulations and may be used in products such as sunscreens, skincare creams, and makeup. In this study, we evaluated the potential of acetonic and aqueous extracts from cyanobacteria strains of the genera Cyanobium and Leptothoe and from strains within Synechococcales and Oscillatoriales orders, for use in cosmetics. Extractions were sequentially performed with acetone and water. Extracts were firstly analyzed for their toxicity to keratinocytes, fibroblasts, and endothelial cells (HaCAT, 3T3L1 and hCMEC/D3, respectively). The non-cytotoxic extracts were characterized in terms of total proteins, carotenoids, chlorophyll, phenols, phycobiliproteins, and analyzed for their antioxidant potential against the superoxide anion radical (O2•−), and for their ability to inhibit key enzymes associated with the skin aging process. Aqueous extracts were richer in total proteins and phycobiliproteins. The aqueous extracts of Synechococcales cyanobacterium LEGE 181157 and Synechococcales cyanobacterium LEGE 181150 showed the highest value for total proteins (760.81 and 695.25 µg BSA mL−1dry extract, respectively) and the best values regarding O2•− scavenging (IC50 = 63.24 and 112.18 µg mL−1dry extract, respectively) with a significant negative correlation observed (p < 0.01). Moreover, aqueous extracts of Synechococcales cyanobacterium LEGE 181150 and Synechococcales cyanobacterium LEGE 181157 inhibited hyaluronidase, (IC50 of 483.86 and 645.06 µg mL−1dry extract, respectively), with a significant negative correlation with total proteins (p < 0.05), pointing out the contribution of these compounds to the biological activities observed. Acetonic extracts were richer in carotenoids and phenols. Zeaxanthin and ß-carotene were predominant among all strains, being present in higher amount in Cyanobium sp. LEGE 07175 (53.08 µg mg−1) and Leptothoe sp. LEGE 181156 (47.89 µg mg−1), respectively. The same strains also showed the highest values for collagenase inhibition at 750 µg mL−1dry extract (32.88 and 36.61%, respectively). Furthermore, Leptothoe sp. LEGE 181156 exhibited the lowest IC50 value for tyrosinase inhibition (465.92 µg mL−1dry extract) and Synechococcales cyanobacterium LEGE 181157 presented the best values for elastase inhibition (IC50 of 380.50 and IC25 of 51.43 µg mL−1dry extract). In general, cyanobacteria extracts demonstrated potential for being used for antiaging purposes, with aqueous extracts being more efficient at free radicals scavenging and acetonic ones at avoiding degradation of dermal matrix components.


Asunto(s)
Cosméticos , Cianobacterias , Antioxidantes/farmacología , Células Endoteliales , Extractos Vegetales/farmacología , Carotenoides/farmacología , Cosméticos/farmacología , Fenoles/farmacología
11.
Ergonomics ; 65(9): 1202-1214, 2022 Sep.
Artículo en Inglés | MEDLINE | ID: mdl-34939893

RESUMEN

This study verified typing performance on smartphones of public transportation passengers using subjective assessments of comfort and difficulty and objective assessments of the number of errors and typing speed. Three frequency values (5, 10, and 15 Hz), two magnitudes (0.6 and 1.2 m/s2) and two types of operating systems (Android and IOS) were adopted. Tests without vibration were applied to analyse the residual effect of vibration. The results showed that vibration significantly influences comfort. The higher the frequency, the less errors and the faster the typing speed. In the magnitude analysis, the increase caused a greater number of errors and greater difficulty. In both assessments, the discomfort was proportional to the increase in frequency or magnitude and the number of errors was inversely proportional to the typing speed. Finally, the IOS operating system showed worse comfort when compared to Android, although no significant differences were observed for the objective assessment. Practitioner summary: Public transportation passengers are exposed to WBV while typing on smartphones. The results showed that vibration influences comfort, the number of errors and the typing speed. Therefore, manufacturers should be aware of the level of vibration that vehicles are exposed to in order to provide more performance to the user. Abbreviations: WBV: whole-body vibration; PID: proportional-integral-derivative; RMS: root mean square; HLM: hierarchical linear modeling; OLS: ordinary least squares; STH: seat-to-head.


Asunto(s)
Teléfono Inteligente , Vibración , Humanos , Transportes , Vibración/efectos adversos
12.
Open Biol ; 11(11): 210224, 2021 11.
Artículo en Inglés | MEDLINE | ID: mdl-34753320

RESUMEN

Gap junctions mediate communication between adjacent cells and are fundamental to the development and homeostasis in multicellular organisms. In invertebrates, gap junctions are formed by transmembrane proteins called innexins. Gap junctions allow the passage of small molecules through an intercellular channel, between a cell and another adjacent cell. The dipteran Rhynchosciara americana has contributed to studying the biology of invertebrates and the study of the interaction and regulation of genes during biological development. Therefore, this paper aimed to study the R. americana innexin-2 by molecular characterization, analysis of the expression profile and cellular localization. The molecular characterization results confirm that the message is from a gap junction protein and analysis of the expression and cellular localization profile shows that innexin-2 can participate in many physiological processes during the development of R. americana.


Asunto(s)
Conexinas/genética , Conexinas/metabolismo , Nematocera/crecimiento & desarrollo , Análisis de Secuencia de ADN/métodos , Animales , Mapeo Cromosómico , Biología Computacional , Conexinas/química , Regulación del Desarrollo de la Expresión Génica , Proteínas de Insectos/química , Proteínas de Insectos/genética , Proteínas de Insectos/metabolismo , Modelos Moleculares , Nematocera/genética , Nematocera/metabolismo , Cromosomas Politénicos/genética , Conformación Proteica , Distribución Tisular
13.
ACS Chem Neurosci ; 12(24): 4500-4511, 2021 12 15.
Artículo en Inglés | MEDLINE | ID: mdl-34808043

RESUMEN

Tyrosine kinase inhibitors (TKIs) are antitumor compounds that prevent the phosphorylation of proteins in a biological environment. However, the multitarget performance of TKIs promotes them as possible candidates for drug repositioning. In this work, interaction and inhibition studies through spectroscopic and computational techniques to evaluate the binding effectiveness of lapatinib and pazopanib TKIs to acetylcholinesterase (AChE) are reported. The results indicated potent inhibition at the µM level. The types of inhibition were identified, with pazopanib acting through non-competitive inhibition and lapatinib through acompetitive inhibition. The fluorescence suppression studies indicate a static mechanism for lapatinib-AChE and pazopanib-AChE systems, with a binding constant in the order of 105 M-1. The obtained thermodynamic parameters reveal interactions driven by van der Waals forces and hydrogen bonds in the lapatinib-AChE system (ΔH° and ΔS° < 0). In contrast, the pazopanib-AChE system shows positive ΔH° and ΔS°, characteristic of hydrophobic interactions. The Foster resonance energy transfer study supports the fluorescence studies performed. The 3D fluorescence studies suggest changes in the microenvironment of the tryptophan and tyrosine residues of the protein in contact with lapatinib and pazopanib. The results suggest effective inhibition and moderate interaction of the drugs with AChE, making them interesting for conducting more in-depth repositioning studies as AChE inhibitors.


Asunto(s)
Acetilcolinesterasa , Preparaciones Farmacéuticas , Acetilcolinesterasa/metabolismo , Sitios de Unión , Indazoles , Lapatinib , Unión Proteica , Pirimidinas/farmacología , Sulfonamidas , Termodinámica
14.
Colloids Surf B Biointerfaces ; 207: 112006, 2021 Nov.
Artículo en Inglés | MEDLINE | ID: mdl-34343910

RESUMEN

Small organic molecules have been extensively applied to achieve enzymatic inhibition. Although numerous efforts have been made to deliver efficient inhibitors, small inhibitors applications are hindered by many drawbacks. Moreover, reporters comprising nanoparticle inhibitory activity against enzymes are very scarce in the literature. In this scenario, carbon nanodots (CDs) emerge as promising candidates for efficient enzyme inhibition due to their unique properties. Here, CDs specific molecular characteristics (core composition and chemical surface groups) have been investigated to produce a more potent enzyme inhibition. Mushroom tyrosinase (mTyr) has been adopted as an enzymatic prototype. The CDs revealed a high affinity to mTyr (Ka ≈ 106 M-1), mainly through hydrophobic forces and followed by slight mTyr structural alteration. CDs competitively inhibit mTyr, with low inhibition constant (KI = 517.7 ±â€¯17.0 nM), which is up 70 fold smaller then the commercial inhibitor (kojic acid) and the starch nanoparticles previously reported. The results expose that the CDs act as a hydrophobic agglomerate with carboxyl groups on its surface, mimicking characteristics found on small molecule inhibitors (but with superior performance). All these results highlight the CD excellent potential as an efficient low toxic Tyr inhibitor, opening the prospect of using these nanoparticles in the cosmetic and food industries.


Asunto(s)
Carbono , Nanopartículas , Inhibidores Enzimáticos/farmacología , Monofenol Monooxigenasa , Almidón
15.
Front Pharmacol ; 12: 655981, 2021.
Artículo en Inglés | MEDLINE | ID: mdl-34054536

RESUMEN

Venomous molluscs (Superfamily Conoidea) comprise a substantial fraction of tropical marine biodiversity (>15,000 species). Prior characterization of cone snail venoms established that bioactive venom components used to capture prey, defend against predators and for competitive interactions were relatively small, structured peptides (10-35 amino acids), most with multiple disulfide crosslinks. These venom components ("conotoxins, conopeptides") have been widely studied in many laboratories, leading to pharmaceutical agents and probes. In this review, we describe how it has recently become clear that to varying degrees, cone snail venoms also contain bioactive non-peptidic small molecule components. Since the initial discovery of genuanine as the first bioactive venom small molecule with an unprecedented structure, a broad set of cone snail venoms have been examined for non-peptidic bioactive components. In particular, a basal clade of cone snails (Stephanoconus) that prey on polychaetes produce genuanine and many other small molecules in their venoms, suggesting that this lineage may be a rich source of non-peptidic cone snail venom natural products. In contrast to standing dogma in the field that peptide and proteins are predominantly used for prey capture in cone snails, these small molecules also contribute to prey capture and push the molecular diversity of cone snails beyond peptides. The compounds so far characterized are active on neurons and thus may potentially serve as leads for neuronal diseases. Thus, in analogy to the incredible pharmacopeia resulting from studying venom peptides, these small molecules may provide a new resource of pharmacological agents.

16.
Spectrochim Acta A Mol Biomol Spectrosc ; 252: 119511, 2021 May 05.
Artículo en Inglés | MEDLINE | ID: mdl-33561686

RESUMEN

The plant popularly known as "negramina" (Siparuna guianensis Aubl.), member of the family Siparunaceae produces an essential oil that presents several biological activities reported in literature. Here, the essential oil was obtained by hydrodistillation from fresh leaves collected in the state of Roraima, far north of the Amazon. Chemical composition of the essential oil was characterized by gas chromatography coupled to mass spectrometry (GC-MS) and flame ionization detector (GC-FID). The sesquiterpenoid shyobunone and its derivatives were identified as major compounds in the oil (>40%). The effect of S. guianensis essential oil on the acetylcholinesterase (AChE) activity from Crassostrea rhizophorae, Litopenaeus vannamei and Electrophorus electricus was tested by spectrophotometric assays. The essential oil has been identified as an AChE inhibitor. The mechanism of inhibition was investigated as well as spectrofluorimetric interactions between the essential oil and the enzyme. 1H NMR titration and molecular docking were also investigated. The spectrophotometric results revealed that shyobunone and its derivatives strongly interact with AChE with a kind of non-competitive inhibition. Interaction studies support the results of enzyme inhibition. Molecular coupling predicted that iso-shyobunone is the strongest ligand, corroborated by fluorescence suppression and 1H NMR titration results. In conclusion, Siparuna guianensis essential oil can be a new source of shyobunone and derivatives capable to reversibly inhibit AChE showing potential neuroprotective properties to be applied in the treatment of Alzheimer's disease.


Asunto(s)
Aceites Volátiles , Sesquiterpenos , Cromatografía de Gases y Espectrometría de Masas , Simulación del Acoplamiento Molecular , Aceites Volátiles/farmacología , Hojas de la Planta , Sesquiterpenos/farmacología
17.
OTJR (Thorofare N J) ; 41(1): 15-23, 2021 01.
Artículo en Inglés | MEDLINE | ID: mdl-32741244

RESUMEN

Time use studies uncover the organization of daily routine of families of children with disabilities. The objective of this study is to identify determinants of time spent caring for children/adolescents with cerebral palsy (CP), autism spectrum disorder (ASD), and typical development (TD). Participants were caregivers of children/adolescents with/without disability. Structural equation modeling tested a proposed model of time spent in child care. The variables in the model were as follows: questionnaire (families' socioeconomic status [SES]), children's functioning (The Pediatric Evaluation of Disability Inventory-Computer Adaptive Test [PEDI-CAT]); hours of care (daily diaries), number of adaptations used, and help with child care (parents' report). Distinct variable combinations explained 78% of the variation in the time to care (TD model), followed by 42% (ASD) and 29% (CP). Adaptations indirectly affected time to care through its effect on functioning (CP); family's SES affected functioning through its effect on adaptation use (ASD). In conclusion, knowledge of factors affecting caregivers' time spent on children's care help occupational therapists implement family-centered strategies.


Asunto(s)
Trastorno del Espectro Autista , Parálisis Cerebral , Personas con Discapacidad , Adolescente , Cuidadores , Niño , Humanos , Encuestas y Cuestionarios
18.
Chemosphere ; 263: 128029, 2021 Jan.
Artículo en Inglés | MEDLINE | ID: mdl-33297050

RESUMEN

Pyriproxyfen is an insecticide used worldwide that acts as a biomimetic of juvenile hormone. This study investigated metabolic and synaptic impairments triggered by pyriproxyfen using zebrafish acetylcholinesterase (zbAChE) and mitochondria as markers. A brain zbAChE assay was performed in vitro and in vivo covering a range of pyriproxyfen concentrations (0.001-10 µmol/L) to assess inhibition kinetics. Docking simulations were performed to characterize inhibitory interactions. Zebrafish male adults were acutely exposed to 0.001, 0.01 and 0.1 µg/mL pyriproxyfen for 16 h. Mitochondrial respiration of brain tissues was assessed. ROS generation was estimated using H2DCF-DA and MitoSOX. Calcium transport was monitored by Calcium Green™ 5 N. NO synthesis activity was estimated using DAF-FM-DA. Brain acetylcholinesterase showed an in vivo IC20 of 0.30 µmol/L pyriproxyfen, and an IC50 of 92.5 µmol/L. The inhibitory effect on zbAChE activity was competitive-like. Respiratory control of Complex I/II decreased significantly after insecticide exposure. The MitoSOX test showed that O2- generation had a pyriproxyfen dose-dependent effect. Brain tissue lost 50% of Ca2+ uptake capacity at 0.1 µg/mL pyriproxyfen. Ca2+ release showed a clear mitochondrial impairment at lower pyriproxyfen exposures. Thus, Ca2+ transport imbalance caused by pyriproxyfen may be a novel deleterious mechanism of action. Overall, the results showed that pyriproxyfen can compromise multiple and interconnected pathways: (1) zbAChE impairment and (2) the functioning of the electron transport chain, ROS generation and calcium homeostasis in zebrafish brain mitochondria. Considering the many similarities between zebrafish and human, more caution is needed when pyriproxyfen is used in both urban and agricultural pest control.


Asunto(s)
Acetilcolinesterasa , Pez Cebra , Acetilcolinesterasa/metabolismo , Animales , Encéfalo/metabolismo , Humanos , Masculino , Mitocondrias/metabolismo , Piridinas , Pez Cebra/metabolismo
19.
Int J Biol Macromol ; 168: 676-685, 2021 Jan 31.
Artículo en Inglés | MEDLINE | ID: mdl-33220373

RESUMEN

Egletes viscosa is a plant with therapeutic value due to its antibacterial, antinociceptive and gastroprotective properties. This study aimed to purify, characterize, and evaluate the cytotoxicity of a lectin (EgviL) from the floral capitula of E. viscosa. The lectin was isolated from saline extract through precipitation with ammonium sulfate followed by Sephadex G-75 chromatography. The molecular mass and isoelectric point (pI) of EgviL were determined as well as its temperature and pH stability. Physical-chemical parameters of interaction between EgviL and carbohydrates were investigated by fluorescence quenching and 1H nuclear magnetic resonance (NMR). Cytotoxicity was investigated against human peripheral blood mononuclear cells (PBMCs) and neoplastic cells. EgviL (28.8 kDa, pI 5.4) showed hemagglutinating activity stable towards heating until 60 °C and at the pH range 5.0-7.0. This lectin is able to interact through hydrophobic and electrostatic bonds with galactose and glucose, respectively. EgviL reduced the viability of PBMCs only at the highest concentration tested (100 µg/mL) while was toxic to Jurkat E6-1 cells with IC50 of 24.1 µg/mL,inducing apoptosis. In summary, EgviL is a galactose/glucose-binding protein with acidic character, stable to heating and with cytotoxic effect on leukemic cells.


Asunto(s)
Antineoplásicos Fitogénicos/farmacología , Asteraceae/química , Leucocitos Mononucleares/citología , Lectinas de Plantas/farmacología , Antineoplásicos Fitogénicos/química , Proliferación Celular/efectos de los fármacos , Supervivencia Celular/efectos de los fármacos , Precipitación Química , Estabilidad de Medicamentos , Galactosa/metabolismo , Glucosa/metabolismo , Pruebas de Hemaglutinación , Humanos , Interacciones Hidrofóbicas e Hidrofílicas , Concentración 50 Inhibidora , Punto Isoeléctrico , Células Jurkat , Leucocitos Mononucleares/efectos de los fármacos , Células MCF-7 , Lectinas de Plantas/química
20.
Cad Saude Publica ; 36(11): e00194619, 2020.
Artículo en Portugués | MEDLINE | ID: mdl-33237205

RESUMEN

This study aimed to develop a conceptual model and to explore direct and indirect associations between paid work and life-course factors in a representative national sample of the Brazilian population 50 years and older. The analysis was based on 8,903 participants in the baseline of the Brazilian Longitudinal Study of Aging (ELSI-Brazil). The exposure variables were sociodemographic, health, work, and social interaction variables. Based on a structural equation model, paid work showed total association with lifetime social status in women (standardized coefficient - SC = 0.489) and direct association with capacity for work in men (SC = 0.527). For women alone, an indirect and negative association was observed with lifetime intense physical effort at work, via retirement (SC = -0.156). Men with paid work were more prone to social participation, measured by belonging to groups or associations (SC = 0.209). Among women, this participation was through interaction with family and friends (SC = 0.047), via capacity for work. For both men and women, lifetime health status showed an indirect and positive association (SC = 0.298 men; SC = 0.142 women) with paid work, via capacity for work. All the above-mentioned factors showed a significant association with paid work. The study's results showed that participation in the work market occurs by different mechanisms for men and women, principally considering the factors related to work and social interaction.


O objetivo do estudo foi desenvolver um modelo conceitual e explorar associações diretas e indiretas entre trabalho remunerado e fatores que operam ao longo da vida em amostra nacional representativa da população brasileira com 50 anos e mais. A análise foi baseada em 8.903 participantes da linha de base do Estudo Longitudinal da Saúde dos Idosos Brasileiros (ELSI-Brasil). Os fatores de exposição foram sociodemográficos, de saúde, trabalho e interação social. Utilizando modelo de equações estruturais, observou-se que o trabalho remunerado apresentou associação total com a condição social ao longo da vida entre mulheres (coeficiente de padronização - CP = 0,489) e associação direta com a capacidade para o trabalho entre homens (CP = 0,527). Apenas para as mulheres, associação indireta e negativa foi observada com o esforço físico intenso no trabalho ao longo da vida, via aposentadoria (CP = -0,156). Homens com trabalho remunerado foram mais propensos à participação social, aferida pelo pertencimento a grupos ou associações (CP = 0,209). Entre as mulheres, essa participação ocorreu por meio de interações com família e amigos (CP = 0,047), via capacidade para o trabalho. Tanto entre homens quanto entre mulheres, a condição de saúde ao longo da vida mostrou associação indireta e positiva (CP = 0,298 homens; CP = 0,142 mulheres) com o trabalho remunerado, via capacidade para o trabalho. Todos os fatores mencionados apresentaram associação significativa com o trabalho remunerado. Os resultados do estudo mostraram que a participação de homens e mulheres mais velhos no mercado de trabalho ocorre por mecanismos diferentes, principalmente ao considerar os fatores relacionados ao trabalho e interação.


El objetivo de este estudio fue desarrollar un modelo conceptual y explorar asociaciones directas e indirectas entre trabajo remunerado y factores que operan a lo largo de la vida, en una muestra nacional representativa de población brasileña con 50 años y más. El análisis se basó en 8.903 participantes procedentes del Estudio Brasileño Longitudinal del Envejecimiento (ELSI-Brasil). Los factores de exposición fueron: sociodemográficos, de salud, trabajo e interacción social. Utilizando un modelo de ecuaciones estructurales, se observó que el trabajo remunerado presentó una asociación total con la condición social a lo largo de la vida entre mujeres (coeficiente de estandarización- CP = 0,489) y asociación directa con la capacidad para el trabajo entre hombres (CP = 0,527). Solamente para las mujeres, la asociación indirecta y negativa se observó con el esfuerzo físico intenso en el trabajo a lo largo de la vida, vía jubilación (CP = -0,156). Hombres con trabajo remunerado fueron más propensos a la participación social, medida por la pertenencia a grupos o asociaciones (CP = 0,209). Entre mujeres, esta participación se produjo mediante interacciones con la familia y amigos (CP = 0,047), vía capacidad para el trabajo. Tanto entre hombres como entre mujeres, la condición de salud a lo largo de la vida mostró una asociación indirecta y positiva (CP = 0,298 hombres; CP = 0,142 mujeres) con el trabajo remunerado, vía capacidad para el trabajo. Todos los factores mencionados presentaron una asociación significativa con el trabajo remunerado. Los resultados del estudio mostraron que la participación en el mercado de trabajo de hombres y mujeres mayores se produce por mecanismos diferentes, principalmente al considerar los factores relacionados con el trabajo e interacción social.


Asunto(s)
Envejecimiento , Estado de Salud , Brasil , Femenino , Humanos , Análisis de Clases Latentes , Estudios Longitudinales , Masculino , Factores Socioeconómicos
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