Search Results (451)

The rabies virus (RABV) phosphoprotein (P protein) has multiple functions, including acting as the essential non-catalytic cofactor of the viral polymerase (L protein) for genome replication and transcription; the principal viral antagonist of the interferon (IFN)-mediated innate immune response; and the chaperone for the viral nucleoprotein (N protein). Although P protein is known to undergo phosphorylation by cellular kinases, the location and functions of the phosphorylation sites remains poorly defined. Here, we report the identification by mass-spectrometry (MS) of residues of P protein that are modified by phosphorylation in mammalian cells, including several novel sites. Analysis of P protein with phospho-mimetic and phospho-inhibitory mutations of three novel residues/clusters that were commonly identified by MS (Ser48, Ser183/187, Ser217/219/220) indicate that phosphorylation at each of these sites does not have a major influence on nuclear trafficking or antagonistic functions toward IFN signalling pathways. However, phosphorylation of Ser48 in the N-terminus of P protein impaired function in transcription/replication and in the formation of replication structures that contain complexes of P and N proteins, suggestive of altered interactions of these proteins. The crystal structure of P protein containing the S48E phospho-mimetic mutation indicates that Ser48 phosphorylation facilitates the binding of residues 41–52 of P protein into the RNA-binding groove of non-RNA-bound N protein (N⁰), primarily through the formation of a salt bridge with Arg434 of N protein. These data indicate that Ser48 modification regulates the cycling of P-N⁰ chaperone complexes that deliver N protein to RNA to enable transcription/replication, such that enhanced interaction due to S48E phospho-mimetic mutation reduces N protein delivery to the RNA, inhibiting subsequent transcription/replication processes. These data are, to our knowledge, the first to implicate phosphorylation of RABV P protein in conserved replication functions of the P gene. Full article

As the most unstable crystalline form of calcium carbonate, vaterite is rarely found in nature due to being highly prone to phase transitions. However, its high specific surface area, excellent biocompatibility, and high solubility properties have led to a research boom and the following breakthroughs in the last two decades: (1) From primitive calculations and spectroscopic analyses to modern multidimensional research methods combining calculations and experiments, the crystal structure of vaterite has turned from early identifications in orthorhombic and hexagonal crystal systems to a complex polymorphic structure within the monoclinic crystal system. (2) The formation process of vaterite not only conforms to the classical crystal growth theory but also encompasses the nanoparticle aggregation theory, which incorporates the concepts of oriented nanoparticle assembly and mesoscale transformation. (3) Regardless of the conditions, the formation of vaterite depends on an excess of CO₃²⁻ relative to Ca²⁺, and its stability duration relates to preservation conditions. (4) Vaterite demonstrates significant value in biomedical applications—including bone repair scaffolds, targeted drug carriers, and antibacterial coating materials—leveraging its porous structure, high specific surface area, and exceptional biocompatibility. While it also shows utility in environmental pollutant adsorption and general coating technologies, the current research remains predominantly concentrated on its medical applications. Currently, the rapid transformation of vaterite presents the primary limitation for its industrial application. Future research should prioritize investigating its formation kinetics and stability. Full article

The sustainable valorization of electrolytic manganese residue (EMR) and fly ash (FA) presents critical environmental challenges. This study systematically investigates the performance optimization of EMR-FA ceramic composites through the coordinated regulation of raw material ratios, sintering temperatures, and additive effects. While the composite with 85 g FA exhibits the highest mechanical strength, lowest porosity, and minimal water absorption, the formulation consisting of 45 wt% EMR, 40 wt% FA, and 15 wt% kaolin is identified as a balanced composition that achieves an effective compromise between mechanical performance and solid waste utilization efficiency. Sintering temperature studies revealed temperature-dependent property enhancement, with controlled sintering at 1150 °C preventing the over-firing phenomena observed at 1200 °C while promoting phase evolution. XRD-SEM analyses confirmed accelerated anorthite formation and the morphological transformations of FA spherical particles under thermal activation. Additive engineering demonstrated that 8 wt% CaO addition enhanced structural densification through hydrogrossular crystallization, whereas Na₂SiO₃ induced sodium-rich calcium silicate phases that suppressed anorthite development. Contrastingly, ZrO₂ facilitated zircon nucleation, while TiO₂ enabled progressive performance enhancement through amorphous phase modification. This work establishes fundamental phase–structure–property relationships and provides actionable engineering parameters for sustainable ceramic production from industrial solid wastes. Full article

The sintering of coal gangue ceramsites (CGCs) using belt roasting technology involves the recirculation of flue gases and variations in oxygen concentrations. This study investigates the effects of temperature and pyrolysis atmosphere on the pore structure of CGCs at three temperature levels: 600 °C, 950 °C, and 1160 °C. The results revealed that apparent porosity is primarily influenced by O₂-promoted weight loss and the densification process, while closed porosity is affected by pyrolysis reactions and crystal phase transformations. Below 950 °C, enhancing the oxidative atmosphere facilitates the preparation of porous CGCs, whereas above 950 °C, reducing the oxidative atmosphere favors the preparation of high-strength CGCs. These findings provide valuable insights for the industrial production of CGCs, offering a basis for optimizing sintering parameters to achieve the desired material properties. The latest production equipment, furnished with adjustable atmospheres (such as belt sintering roasters), can better regulate the mechanical properties of the products. Full article

As one of the important lithium resource sources, lepidolite has become a new energy strategic resource research hot spot. The efficient flotation of lepidolite directly affects the recovery and economic value of lithium resources. This paper systematically reviews the flotation research progress of lepidolite, focusing on the influence of the type of capture agent and process parameters (pH, activator, and depressant) on flotation. In view of the separation problems caused by the similarity of the surface properties of lepidolite and its associated gangue minerals (albite, feldspar, and quartz), the strategies for regulating the crystal structure of the minerals and their surface properties are analyzed. In addition, the lepidolite flotation process and its challenges are summarized, including poor selectivity of chemicals, fine mineral embedded size, easy to form sludge, and insufficient environmental friendliness, etc. The future development direction of lepidolite flotation technology is also prospected, which provides theoretical support and reference for the efficient recovery of lepidolite. Full article

The FIC domain-containing protein Sofic has recently been shown to provide robust protection to bacteria against phage infection. Sofic acts as a toxic protein, inducing abortive infection through the AMPylation of target proteins during phage invasion. However, the molecular mechanisms regulating Sofic’s toxic activity remain elusive. In this study, we identified a small gene encoding a short protein located downstream of Sofic in the genome, named AS1 (anti-Sofic1), which functions as an antitoxic protein to counteract Sofic’s toxicity. The crystal structure of Sofic revealed that the protein functions as a dimer in solution, with dimerization being indispensable for its toxic activity. Importantly, structural analysis indicated that ATP binding induces a conformational change in the C-terminal domain (CTD) of Sofic, underscoring the critical role of the CTD in mediating its toxic effects. In vitro colony-forming assays confirmed that the interaction between the CTD and the Amylase domain is crucial for Sofic’s toxic activity. Overall, our results provide molecular insights into the regulatory mechanisms of Sofic in antiviral immunity. Full article

As one of the most important platform chemicals, furfural (FAL) can be converted into high-value-added products such as furfuryl alcohol (FOL) through multiple pathways. Zirconium-based MOF-801 demonstrates exceptional catalytic potential for FAL conversion via catalytic transfer hydrogenation (CTH), owing to its unique crystal defects generated during growth. In this study, a series of defective MOF-801 samples were efficiently synthesized using an air–liquid segmented microfluidic technique. The characterization results reveal that the air–liquid segmented flow method not only regulates the defect content of MOF-801 to expose more active sites but also adjusts the crystal size and pore structures by precisely controlling the reaction time. The enhanced defects in MOF-801 significantly improved its catalytic performance. A-MOF-801-64 exhibited the highest activity, achieving over 99% FAL conversion and 98% FOL selectivity under mild conditions (130 °C, 12 h) using isopropanol as the hydrogen donor; this performance surpassed that of other reported Zr-based catalysts. This study will facilitate the practical applications of defect-engineered MOF-801 in upgrading biomass-derived chemicals. Full article

Background: Malaria remains a significant global health burden, particularly in sub-Saharan Africa, accounting for high rates of illness and death. The growing resistance to frontline antimalarial therapies underscores the urgent need for novel drug targets and therapeutics. Bromodomain-containing proteins, which regulate gene expression through chromatin remodeling, have gained attention as potential targets. Plasmodium falciparum bromodomain protein 1 (PfBDP1), a 55 kDa nuclear protein, plays a key role in recognizing acetylated lysine residues and facilitating transcription during parasite development. Methods: This study investigated ex vivo PfBDP1 gene mutations and identified potential small molecule inhibitors using computational approaches. Malaria-positive blood samples were collected. Genomic DNA was extracted, assessed for quality, and amplified using PfBDP1-specific primers. DNA sequencing and alignment were performed to determine single-nucleotide polymorphism (SNP). Structural modeling used the PfBDP1 crystal structure (PDB ID: 7M97), and active site identification was conducted using CASTp 3.0. Virtual screening and pharmacophore modeling were performed using Pharmit and AutoDock Vina, followed by ADME/toxicity evaluations with SwissADME, OSIRIS, and Discovery Studio. GROMACS was used for 100 ns molecular dynamics simulations. Results: The malaria prevalence rate stood at 12.24%, and the sample size was 165. Sequencing results revealed conserved PfBDP1 gene sequences compared to the 3D7 reference strain. Virtual screening identified nine lead compounds with binding affinities ranging from −9.8 to −10.7 kcal/mol. Of these, CHEMBL2216838 had a binding affinity of −9.9 kcal/mol, with post-screening predictions of favorable drug-likeness (8.60), a high drug score (0.78), superior pharmacokinetics, and a low toxicity profile compared to chloroquine. Molecular dynamics simulations confirmed its stable interaction within the PfBDP1 active site. Conclusions: Overall, this study makes a significant contribution to the ongoing search for novel antimalarial drug targets by providing both molecular and computational evidence for PfBDP1 as a promising therapeutic target. The prediction of CHEMBL2216838 as a lead compound with favorable binding affinity, drug-likeness, and safety profile, surpassing those of existing drugs like chloroquine, sets the stage for preclinical validation and further structure-based drug design efforts. These findings are supported by prior experimental evidence showing significant parasite inhibition and gene suppression capability of predicted hits. Full article

As a contactless physical field, a steady magnetic field (SMF) is capable of acting on substances, which leads to changes in physical and/or chemical properties and to further influencing thermodynamic and kinetic behaviors at macroscopic, mesoscopic, and microscopic scales. The application of the SMF to material science has evolved into an important interdisciplinary field—the Electromagnetic Processing of Materials (EPM). Therein, the implementation of the SMF for the solidification of metals and alloys has been increasingly given attention. The SMF was found to regulate nucleation, crystal growth, the distribution of solutes and structure morphology during alloy solidification via various magnetic effects, such as magnetic damping, the thermoelectric magnetic effect, magnetic orientation and magnetically controlled diffusion. In this review, we briefly summarize the main SMF effects and review recent progress in magnetic field-assisted solidification processing, including nucleation, dendritic growth, solute segregation and interfacial phenomena. Finally, future perspectives regarding controlling alloys’ solidification using an SMF are discussed. Full article

In this study, a poly [ε-caprolactam-co-bis(2-hydroxyethyl) terephthalate] copolymer (P (CL-co-BHET)) was synthesized from para-terephthalic acid (PTA), ethylene glycol (EG), and caprolactam (CL). The crystallization behavior and thermal stability of the copolymer were thoroughly investigated. With the aid of molecular simulation, this study investigated the variation in interchain hydrogen bonding in the copolymer, focusing on the direction and the number of hydrogen bonds. The results revealed a close relationship between the copolymer chain structure, the variation in interchain hydrogen bonding, and the crystallization behavior and thermal stability of the copolymer. The introduction of BHET segments disrupted the regularity of the PA6 backbone and hydrogen bonding, leading to a decrease in the melting point, crystallization temperature, and crystallinity of the copolymer. The thermal stability of the copolymers also decreased, and the crystallization form gradually shifted from the α-crystalline to the γ-crystalline phase. The findings of this study are significant for evaluating the crystallization behavior of polyester amides and for predicting and regulating the properties of polyesteramide polymers. Full article

Drying constitutes an essential step in aerogel fabrication, where the drying method directly determines the pore structure and consequently influences the material’s functionality. This study employed various drying techniques to prepare balsa-wood-derived aerogels, systematically investigating their effects on microstructure, density, and performance characteristics. The results demonstrate that different drying methods regulate aerogels through distinct pore structure modifications. Supercritical CO₂ drying optimally preserves the native wood microstructure, yielding aerogels with superior thermal insulation performance. Freeze-drying induces the formation of ice crystals, which reconstructs the microstructure, resulting in aerogels with minimal density, significantly enhanced permeability, and exceptional cyclic water absorption capacity. Vacuum drying, oven drying, and natural drying all lead to significant deformation of the aerogel pore structure. Among them, oven drying increases the pore quantity of aerogels through volumetric contraction, thereby achieving the highest specific surface area. However, aerogels prepared by air drying have the highest density and the poorest thermal insulation performance. This study demonstrates that precise control of liquid surface tension during drying can effectively regulate both the pore architecture and functional performance of wood-derived aerogels. The findings offer fundamental insights into tailoring aerogel properties through optimized drying processes, providing valuable guidance for material design and application development. Full article

A series of PPCDL-PEG₁₀₀₀-TPU were prepared by melting method using CO₂ based biodegradable polycarbonate diol (PPCDL) and polyethylene glycol (PEG1000) as soft segments, and hexamethylene diisocyanate (HDI) and 1,4-butanediol (BDO) as hard segments. Their structure and properties were characterized to show that the products have nanoscale microphase separation, excellent wear-resistance and high resilience. PPCDL-PEG₁₀₀₀-TPUs have high tensile strength, high elongation at break, controllable hardness and excellent wear resistance when the content of hard segment is about 20%. Compared to PPCDL-TPU with only PPCDL as soft segment, the mechanical properties of TPU increase rather than decrease after the addition of PEG due to the crystallization behavior of PEG units in block copolymers. When the ratios of n_PPCDL:n_PEG are 10:1 and 4:1, the tensile strength of PPCDL-PEG₁₀₀₀-TPU reaches 27.5 MPa and 16.5 MPa (an increase of nearly 200% and 20% than PPCDL-TPU). The elongation at break reaches 1995% and 2485% (an increase of nearly 40% and 75% than PPCDL-TPU). Hardness of the prepared PPCDL-PEG₁₀₀₀-TPUs’ Shore A can be controlled in range of 70~85 by regulating the addition of PEG and their glass transition temperature (Tg) decreases with the increase of the amount of PEG incorporated. All PPCDL-PEG₁₀₀₀-TPUs exhibit good wear resistance with the average Akron wear volume of 12 mm³ after 4000 cycles of experiments according to national standards. PPCDL-PEG₁₀₀₀-TPUs show a high resilience performance with a negligible change in the hysteresis loop area after six cycles of tensile stretching. Furthermore, all PPCDL-PEG₁₀₀₀-TPUs possess high thermal stability, strong hydrophobicity, and low water absorption. This material has excellent application prospects and competitiveness in footwear and shock-absorbing materials. Full article

Cytochromes P450 (CYPs) form one of the largest enzyme superfamilies, with similar structural folds yet biological functions varying from synthesis of physiologically essential compounds to metabolism of myriad xenobiotics. Sterol 14α-demethylases (CYP51s) represent a very special P450 family, regarded as a possible evolutionary progenitor for all currently existing P450s. In metazoans CYP51 is critical for the biosynthesis of sterols including cholesterol. Here we determined the crystal structures of ligand-free CYP51s from the abyssal fish Coryphaenoides armatus and human-. Comparative sequence–structure–function analysis revealed specific structural elements that imply elevated conformational flexibility, uncovering a molecular basis for faster catalytic rates, lower substrate selectivity, and intrinsic resistance to inhibition. In addition, the C. armatus structure displayed a large-scale repositioning of structural segments that, in vivo, are immersed in the endoplasmic reticulum membrane and border the substrate entrance (the FG arm, >20 Å, and the β4 hairpin, >15 Å). The structural distinction of C. armatus CYP51, which is the first structurally characterized deep sea P450, suggests stronger involvement of the membrane environment in regulation of the enzyme function. We interpret this as a co-adaptation of the membrane protein structure with membrane lipid composition during evolutionary incursion to life in the deep sea. Full article

In response to the performance requirements of ship conductive rings in the coupled environment of high salt spray, high humidity, and mechanical wear in the ocean, a Cu-TiC composite coating was prepared on the surface of 7075 aluminum alloy by using the high-speed laser cladding (HLC) technology. The influence laws of the scanning speed (86.4–149.7 mm/s) on the microstructure, tribological properties, and corrosion resistance of the coating were explored. The results show that the scanning speed significantly changes the phase composition and grain morphology of the coating by regulating the thermodynamic behavior of the molten pool. At a low scanning speed (86.4 mm/s), the CuAl₂ phase is dominant, and the grains are mainly columnar crystals. As the scanning speed increases to 149.7 mm/s, the accelerated cooling rate promotes an increase in the proportion of Cu₂Al₃ phase, refines the grains to a coexisting structure of equiaxed crystals and cellular crystals, and improves the uniformity of TiC particle distribution. Tribological property analysis shows that the high scanning speed (149.7 mm/s) coating has a 17.9% lower wear rate than the substrate due to grain refinement and TiC interface strengthening. The wear mechanism is mainly abrasive wear and adhesive wear, accompanied by slight oxidative wear. Electrochemical tests show that the corrosion current density of the high-speed cladding coating is as low as 7.36 × 10⁻⁷ A·cm⁻², and the polarization resistance reaches 23,813 Ω·cm². The improvement in corrosion resistance is attributed to the formation of a dense passivation film and the blocking of the Cl diffusion path. The coating with a scanning speed of 149.7 mm/s exhibits optimal wear-resistant and corrosion-resistant synergistic performance and is suitable for the surface strengthening of conductive rings in extreme marine environments. This research provides theoretical support for the process performance regulation and engineering application of copper-based composite coatings. Full article

Silver nanostructures exhibit exceptional surface-enhanced Raman scattering (SERS) performance due to their strong plasmonic resonance. However, their practical applications are often hindered by structural instability, leading to deformation and performance degradation. In this study, we developed a kinetics-controlled synthetic strategy to fabricate gold-encapsulated silver (Au@Ag) hierarchical superstructures (HSs) with enhanced SERS activity and stability. By leveraging polyvinylpyrrolidone (PVP) as a surface modifier and precisely regulating the introduction rate of reaction precursors, we achieved meticulous control over the galvanic replacement kinetics, thereby preserving the structural integrity of pre-synthesized Ag HSs during the formation of Au@Ag HSs. The resulting well-defined Au@Ag HSs demonstrated superior SERS performance, achieving a detection limit of 10⁻⁹ M for crystal violet (CV) while exhibiting outstanding signal reproducibility (relative standard deviation, RSD = 11.60%). This work provides a robust and scalable approach to designing stable, high-efficiency SERS-active nanostructures with broad potential in analytical and sensing applications. Full article