Charge Region Research Articles

Enhanced sludge solid-liquid separation based on Fe2+/periodate conditioning coupled with polyoxometalates: Cell destruction and protein adsorption

Dewatering of waste activated sludge is a necessary step for achieving subsequent reduction, stabilization, and resource utilization. In this study, Fe2+/periodate (PI) coupled with polyoxometalates (POMs) conditioning was tested for realizing sludge deep dewatering. After the addition of POMs (0.20 mmol g−1 VSS), Fe2+/PI/POMs conditioning enhanced the efficiency of sludge dewatering by 42.93% compared to Fe2+/PI conditioning. It was found that the electrostatic repulsion posed a significant influence on the interaction between POMs and proteins. The reduction of electrostatic repulsion facilitated the proximity of POMs to the sludge flocs and promoted its reaction. The strong acidity and interaction with cells of POMs could induce the damage or apoptosis in sludge cells, resulting in the release of intracellular substances. The active radicals generated by Fe2+/PI process attacked TB-EPS, causing the dissolution of EPS and the decomposition of hydrophilic substances. With the assistance of Fe2+/PI process, POMs exhibited an enhanced cell-disruptive effect, thereby inducing the liberation of a greater quantity of intracellular substances. Moreover, Fe2+/PI/POMs conditioning effectively lowered the zeta potential of sludge system, facilitating the interaction between negatively charged POMs anions and the positively charged regions of proteins. This interaction tended to favor adsorption and precipitation rather than destruction. The adsorption and sedimentation of proteins by POMs further reduced the hydrophilicity of sludge system, thereby enhancing sludge dewaterability. Furthermore, POMs could enhance the electron transfer capacity of sludge system, which was beneficial for subsequent filtrate denitrification treatment.

A New TiO2‐Based Cathode Material with Interface‐Dominated Storage Mechanism for Aqueous Zinc‐Ion Batteries

AbstractAqueous zinc‐ion batteries (AZIBs) are highly desirable for large‐scale energy storage applications, yet the lack of suitable cathode materials hinders their deployment. Here, for the first time, a new and promising TiO2‐based cathode material (TOC‐AI) is reported for AZIBs and unveil a novel energy storage mechanism that enables Zn2+ storage predominantly originating from the interface. The TOC‐AI composed of ultrafine TiO2 nanocrystals embedded within an amorphous carbon matrix, featuring abundant atomic interfaces and strong interactions, triggers a decoupled and rapid transport of Zn2+ ions and electrons in the interfacial space charge region, similar to an electrostatic capacitor. Moreover, the presence of titanium vacancies facilitates Zn2+ intercalation into the TiO2 bulks, contributing extra capacity to the composite. Finally, a high capacity of 111 mAh g−1 and excellent cycling performance with 77% capacity retention after 17 000 cycles are achieved. Such interface‐dominated storage mechanism has also been successfully extended to other composite systems, broadening the scope of potential applications for materials traditionally deemed inactive for Zn2+ storage.

Design of non-fluorinated proton exchange membranes from Poly(Terphenyl fluorenyl isatin) with fluorene-linked sulfonate groups and microblock structures

Proton exchange membranes (PEMs) are essential components in energy storage and conversion devices, such as fuel cells and electrolyzers. In this study, we developed a series of non-fluorinated PEMs from poly (terphenyl fluorenyl isatin) with fluorene-pendent disulfonate groups. These polymers feature a microblock structure composed of hydrophobic blocks, hydrophilic blocks, and alternating blocks, arising from the differences in reactivity, concentration, and solubility between the hydrophobic p-terphenyl and hydrophilic disulfonated fluorene monomers. As a result, the sulfonic acid groups are unevenly distributed along the polymer chains, forming densely charged regions (IEC = 3.52 meq/g) with large ion clusters and lightly charged regions (IEC = 2.16 meq/g) with small ion clusters. This microstructure, combined with the degree of sulfonation, significantly influences the overall properties of the membranes, including robust mechanical strength (47.1–63.2 MPa), high thermal stability (up to 270 °C), low swelling ratio (18–25 % at 80 °C), and high proton conductivity (136–169 mS/cm in deionized water at 80 °C). The PFLSH60 membrane demonstrated comparable fuel cell performance to Nafion 212. Its hydrogen crossover current density was more than two times lower (0.86 mA/cm2 for PFLSH60 compared to 1.83 mA/cm2 for Nafion 212) under testing conditions of 80 °C and 100 % RH. This significantly reduced crossover improves fuel utilization in fuel cell stacks. This work offers valuable insights into the design of robust, high-performance PEMs by systematically analyzing the relationships between membrane structure, properties, and performance.

A structural analysis of the splice-specific functional impact of the pathogenic familial hemiplegic migraine type 1 S218L mutation on Cav2.1 P/Q-type channel gating

P/Q-type (Cav2.1) calcium channels mediate Ca2+ influx essential for neuronal excitability and synaptic transmission. The CACNA1A gene, encoding the Cav2.1 pore forming subunit, is highly expressed throughout the mammalian central nervous system. Alternative splicing of Cav2.1 pre-mRNA generates diverse channel isoforms with distinct biophysical properties and drug affinities, which are differentially expressed in nerve tissues. Splicing variants can also affect channel function under pathological conditions although their phenotypic implication concerning inherited neurological disorders linked to CACNA1A mutations remains unknown. Here, we quantified the expression of Cav2.1 exon 24 (e24) spliced transcripts in human nervous system samples, finding different levels of expression within discrete regions. The corresponding Cav2.1 variants, differing by the presence (+) or absence (Δ) of Ser-Ser-Thr-Arg residues (SSTR) in the domain III S3-S4 linker, were functionally characterized using patch clamp recordings. Further, the + /ΔSSTR isoforms were used to demonstrate the differential impact of the Familial Hemiplegic Migraine Type 1 (FHM-1) S218L mutation, located in the domain I S4-S5 linker, on the molecular structure and electrophysiological properties of Cav2.1 isoforms. S218L has a prominent effect on the voltage-dependence of activation of +SSTR channels when compared to ΔSSTR, indicating a differential effect of the mutation depending on splice-variant context. Structural modeling based upon Cav2.1 cryo-EM data provided further insight reflecting independent contributions of amino acids in distant regions of the channel on gating properties. Our modelling indicates that by increasing hydrophobicity the Leu218 mutation contributes to stabilizing a structural conformation in which the domain I S4-S5 linker is oriented alongside the inner plasma membrane, similar to that occurring when S4 is translocated upon activation.The SSTR insertion appears to exert an influence in the local electric field of domain III due to an change in the distribution of positively charged regions surrounding the voltage sensing domain, which we hypothesize impacts its movement during the transition to the open state. In summary, we reveal molecular changes correlated with distinct functional effects provoked by S218L FHM-1 mutation in hCav2.1 splice isoforms whose differential expression could impact the manifestation of the neurological disorder.

Controllable Ultrathin Nickel Nanoislands With Dense Discrete Space Charge Regions: Steering Hole Extraction for High-Performance Underwater Multispectral Weak-Light Photodetection.

Undersea optical communication (UOC) is vital for ocean exploration and military applications. In the dim-light underwater environment, photodetectors must maximize photon utilization by minimizing optical losses and carrier recombination. This can be achieved by integrating ultrathin metal nanostructures with photocatalysts to form Schottky junctions, which enhance charge separation and injection while mitigating metal-induced light shading. The strategic design of discrete metal nanostructures providing numerous high-depth space charge regions (SCRs) without overlap offers a promising approach to optimize hole transport paths and further suppress recombination. Here, a facile phase-separation lithography technique is explored to fabricate tunable ultrathin Ni nanoislands atop n-Si, yielding high-performance photoelectrochemical photodetectors (PEC PDs) tailored for underwater weak-light environments. This results indicate that key determinant of hole extraction behavior is the relationship between the spacing distance of adjacent Ni nanostructures (ds) and twice the SCR radius (Ws). PEC PDs with optimized 8nm ultrathin Ni nanostructures featuring closely but non-overlapping SCRs, exhibit a 55-fold increase in photoresponsivity (2.2mAW-1) and a 128-fold enhancement in detection sensitivity (3.2 × 1011 Jones) at 0V over Ni film, revealing the exceptional stability. Furthermore, this approach enables effective detection across UV-vis-near infrared spectrum, supporting reliable multispectral UOC and underwater imaging capabilities.

Unleashing the Potential of Tailored ZnO-MgO Nanocomposites for the Enhancement of NO2 Sensing Performance at Room Temperature.

Surface functionalization of semiconducting metal oxides has emerged as a highly effective approach for enhancing their sensing capabilities. In the present work, the surface of randomly oriented zinc oxide (ZnO) nanowires is modified with an optimized thickness (7 nm) of magnesium oxide (MgO), which exhibits an exceptionally sensitive and selective behavior toward NO2 gas, yielding a response of approximately 310 for 10 ppm concentration at room temperature. The synergistic interplay between ZnO and MgO leads to a remarkable 20-fold improvement in sensor response compared to a pristine ZnO film and allows the detection of concentrations as low as 50 ppb. The ZnO-MgO composite was characterized using X-ray diffraction (XRD), XPS, and SEM-EDS to gain structural, compositional, and morphological insights. The interaction of the NO2 molecule with the sensor film was investigated using density functional theory (DFT) simulations, revealing that oxygen vacant sites on the MgO surface are most favorable for NO2 adsorption, with an adsorption energy of -3.97 eV and a charge transfer of 1.74e toward NO2. The XPS, photoluminescence (PL), and EPR measurements experimentally verified the presence of oxygen vacancies in the sensing material. The introduction of localized levels within the band gap by oxygen vacancies significantly promotes the interaction of gas molecules with these sites, which enhances the charge transfer toward NO2 gas molecules. This augmentation has a profound influence on the space charge region at the ZnO-MgO interface, which is pivotal for modulating the charge transport in the ZnO layer, resulting in the substantial improvement of NO2 response at room temperature.

Achieving Dendrite-Free Lithium Metal Batteries by Constructing a Dense Lithiophilic Cu1.8Se/CuO Heterojunction Tip.

Lithium (Li)metal batteries (LMBs) have garnered widespread attention due to their high specific capacity. However, the growth of lithium dendrite severely limits their practical applications. Herein, a novel strategy is proposed to regulate the overall potential strength and lithium ions (Li+) concentration on the surface of the current collector by utilizing densely distributed tip effects. This concept is exemplified through the construction of lithiophilic Cu1.8Se/CuO heterojunction needle array on the Cu foil, ultimately achieving dendrite-free lithium deposition. Based on the simulation in COMSOL multiphysics and experimental research, this design is demonstrated to enrich Li+ on the current collector surface, delay the formation of space charge regions, and mitigate the growth of lithium dendrites. Additionally, a built-in electric field (BIEF) triggered by the heterointerface between Cu1.8Se and CuO further alleviates the Li+ concentration gradient on the electrode surface, achieving uniform bottom-up deposition of Li within the array structure. Consequently, the symmetrical cell exhibits an ultra-long cycle life of 2400h (1mAcm-2, 1mAhcm-2) with an extremely low overpotential of 13mV. Furthermore, full batteries using LiFePO4 as the cathode exhibit superior cycle stability and rate performance. This study presents a promising approach for designing dendrite-free current collectors in LMBs.

Exploring the orphan immune receptor TREM2 and its non-protein ligands: In silico characterization

The triggering receptor expressed on myeloid cells 2 (TREM2) is an immunoreceptor that interacts with a wide range of non-protein ligands, and it has been implicated in infectious and non-infectious diseases. However, there is a limited understanding on how this receptor interacts with non-protein ligands and the potential of such information to develop new therapeutic drugs. Therefore, our study aimed to elucidate the interactions between TREM2 and its non-protein ligands. First, we searched PubChem and Protein Data Bank (PDB) for TREM2 structures and their corresponding non-protein ligands. Subsequently, these structures were employed in molecular docking and MM/GBSA simulations with the Maestro software and molecular dynamics in GROMACS software. TREM2 was subsequently subjected to druggable site prediction using CavityPlus and receptor-based drug repositioning via the DrugRep server. TREM2 interacts with high affinity with its 12 non-protein ligands, with affinity values ranging from −33.01 kcal/mol for phosphatidylserine to −80.87 kcal/mol for cardiolipin (CLP). In molecular dynamics simulations, homodimeric TREM2 bound more stably to its lipid ligands, such as CLP and PSF, whereas it was unstable when unbound. The interactions between the receptor and its non-protein ligands were driven by the complementarity determining regions (CDR) 1 and 2, that are present in the hydrophobic and positively charged regions, highlighting that the Y38–R98 region is fundamental for drugs targeting TREM2. Our data underscore the significance of TREM2's CDRs in recognizing its ligands, suggesting they as promising targets for prospective drug design studies.

The prolyl isomerase FKBP11 is a secretory translocon accessory factor.

Eukaryotic cells encode thousands of secretory and membrane proteins, many of which are cotranslationally translocated into the endoplasmic reticulum (ER). Nascent polypeptides entering the ER encounter a network of molecular chaperones and enzymes that facilitate their folding. A rate-limiting step for some proteins is the trans-to-cis isomerization of the peptide bond between proline and the residue preceding it. The human ER contains six prolyl isomerases, but the function, organization, and substrate range of these proteins is not clear. Here we show that the metazoan-specific, prolyl isomerase FKBP11 binds to ribosome-translocon complexes (RTCs) in the ER membrane, dependent on its single transmembrane domain and a conserved, positively charged region at its cytosolic C-terminus. High-throughput mRNA sequencing shows selective engagement with ribosomes synthesizing secretory and membrane proteins with long translocated segments, and functional analysis shows reduced stability of two such proteins, EpCAM and PTTG1IP, in cells depleted of FKBP11. We propose that FKBP11 is a translocon accessory factor that acts on a broad range of soluble secretory and transmembrane proteins during their synthesis at the ER.

Development of Semi-Empirical and Machine Learning Models for Photoelectrochemical Cells

We introduce a theoretical model for the photocurrent-voltage (I-V) characteristics designed to elucidate the interfacial phenomena in photoelectrochemical cells (PECs). This model investigates the sources of voltage losses and the distribution of photocurrent across the semiconductor–electrolyte interface (SEI). It calculates the whole exchange current parameter to derive cell polarization data at the SEI and visualizes the potential drop across n-type cells. The I-V model’s simulation outcomes are utilized to distinguish between the impacts of bulk recombination and space charge region (SCR) recombination within semiconductor cells. Furthermore, we develop an advanced deep neural network model to analyze the electron–hole transfer dynamics using the I-V characteristic curve. The model’s robustness is evaluated and validated with real-time experimental data, demonstrating a high degree of concordance with observed results.

Constructing Quasi-Single Ion Conductors by a β-Cyclodextrin Polymer to Stabilize Zn Anode.

Aqueous Zn-ion batteries (AZIBs) are promising for the next-generation large-scale energy storage. However, the Zn anode remains facing challenges. Here, we report a cyclodextrin polymer (P-CD) to construct quasi-single ion conductor for coating and protecting Zn anodes. The P-CD coating layer inhibited the corrosion of Zn anode and prevented the side reaction of metal anodes. More important is that the cyclodextrin units enabled the trapping of anions through host-guest interactions and hydrogen bonds, forming a quasi-single ion conductor that elevated the Zn ion transference number (from 0.31 to 0.68), suppressed the formation of space charge regions and hence stabilized the plating/striping of Zn ions. As a result, the Zn//Zn symmetric cells coated with P-CD achieved a 70.6 times improvement in cycle life at high current densities of 10 mA cm-2 with 10 mAh cm-2. Importantly, the Zn//K1.1V3O8 (KVO) full-cells with high mass loading of cathode materials and low N/P ratio of 1.46 reached the capacity retention of 94.5 % after 1000 cycles at 10 A g-1; while the cell without coating failed only after 230 cycles. These results provide novel perspective into the control of solid-electrolyte interfaces for stabilizing Zn anode and offer a practical strategy to improve AZIBs.

Constructing Quasi‐Single Ion Conductors by a β‐Cyclodextrin Polymer to Stabilize Zn Anode

AbstractAqueous Zn‐ion batteries (AZIBs) are promising for the next‐generation large‐scale energy storage. However, the Zn anode remains facing challenges. Here, we report a cyclodextrin polymer (P‐CD) to construct quasi‐single ion conductor for coating and protecting Zn anodes. The P‐CD coating layer inhibited the corrosion of Zn anode and prevented the side reaction of metal anodes. More important is that the cyclodextrin units enabled the trapping of anions through host–guest interactions and hydrogen bonds, forming a quasi‐single ion conductor that elevated the Zn ion transference number (from 0.31 to 0.68), suppressed the formation of space charge regions and hence stabilized the plating/striping of Zn ions. As a result, the Zn//Zn symmetric cells coated with P‐CD achieved a 70.6 times improvement in cycle life at high current densities of 10 mA cm−2 with 10 mAh cm−2. Importantly, the Zn//K1.1V3O8 (KVO) full‐cells with high mass loading of cathode materials and low N/P ratio of 1.46 reached the capacity retention of 94.5 % after 1000 cycles at 10 A g−1; while the cell without coating failed only after 230 cycles. These results provide novel perspective into the control of solid‐electrolyte interfaces for stabilizing Zn anode and offer a practical strategy to improve AZIBs.

Circuit Modeling of the Impact of Heavy Charged Particles on Transient Processes in Bipolar Analog Microcircuits

One of the factors causing the failure of spacecraft integrated circuits is exposure to heavy charged particles. The entry of heavy charged particles into electronic devices leads to the appearance of single event transients (short current pulses), which in analog microcircuits manifest themselves in distortion of the output signal shape, and in digital microcircuits can cause a single event upset. The article discusses a technique for circuit mode-ling of the effect of heavy charged particles on bipolar analog microcircuits, including the developed equivalent electrical circuit of a bipolar transistor for LTSpice and the procedure for modeling transient processes. Despite the simplifications adopted, namely: failure to take into account the dependence of the duration of the rise and fall of the current pulse generated by a charged particle on the parameters of the transistor structure, the assumption that the entire charge is generated in the active base and the space charge regions of the emitter and collector junctions, an equivalent circuit has been developed made it possible to determine that the shape of the collector current pulse for circuit with a common emitter when exposed to a heavy charged particle is determined by the speed of the transistor and its operating mode. Using the developed methodology, the “critical” transistors of the two studied analog microcircuits were determined, and the need to bypass the current-setting resistors with a small capacitor was justified.

Fabrication of heterostructure multilayer devices through the optimization of Bi-metal sulfides for high-performance quantum dot-sensitized solar cells.

In this work, a titanium dioxide and lead sulfide (TiO2/PbS) nano-size heterostructure with tin sulfide was fabricated and coated via a two-step direct deposition process. Its microstructure, morphology, elemental composition, optical absorption, and photochemical activity were investigated. Linear sweep voltammetry and cyclic voltammetry curves substantiated its catalytic activity, indicating quantum dot effects of a well-developed space charge domain on the surface of the hybrid structure. These give rise to electron-hole recombination suppression and a high charge mobility rate. Moreover, direct stabilization was identified in current density, corresponding to the hybrid structures limiting the diffusion current process. Higher J SC values observed were substantiated by the role of quantum dot-size effects and enhanced crystalline structures, leading to a reduction in series resistance and an improved conversion efficiency of 10.05%. Overall, theoretical analyses and empirical findings indicated that the seamless migration of photoexcited electrons across the interfaces of SnS and PbS is linked to quantum dot effect synergy. This is facilitated by the space charge region, which serves as a conduit for efficient electron transfer between the respective materials.

High‐Gain and Tunable Linear Photodetection in 2D Tunneling Heterostructures Through Potential Engineering

Abstract2D materials are extensively employed in the fabrication of high‐performance photodetectors owing to their exceptional physical properties. However, most 2D material photodetectors fail to sustain high gain under intense illumination due to the limited intrinsic trap states. Here, an n‐n type Bi2O2Se/SnSe2 van der Waals tunneling heterojunction photodetector with a detection range from visible to near‐infrared (VIS‐NIR) is presented. Under reverse bias, the heterojunction induces a significant electron barrier and hole potential well, ensuring low leakage current and ample hole defect states. Therefore, the photodetector demonstrated a responsivity of 1636.3 AW−1 and a detectivity of 1.39 × 1014 Jones under 660 nm illumination, maintaining a tunable linear dynamic range (LDR) of ≈74.7 dB. This performance is attributed to the hole potential well‐suppressing the recombination of photogenerated carriers, thereby enhancing the device's gain. Furthermore, the tunneling of photogenerated electrons within the heterojunction's space charge region under bias enables rapid response (75.1 and 15.6 µs). In summary, the study introduces a novel strategy to overcome the limited detection capabilities of 2D devices under intense illumination, characterized by outstanding linearity for rapid detection and high‐resolution imaging.

Increasing the Efficiency of Thermoelectric Conversion of Solar Energy

The article considers the latest achievements in the field of thermionic conversion of solar energy. The key aspects of thermionic emission, the problems of reducing the electrode work function and increasing the efficiency of devices are analyzed. It is shown that diamonds doped with phosphorus can be an attractive material for the purposes of thermionic emission. In this case, the presence of donor states can significantly narrow the space charge region, and at the same time reduce the potential barrier in the work function. The studies also found that the most successful and widely used method for overcoming the space charge effect is filling the interelectrode gap with cesium. The efficiency of thermionic conversion devices for solar energy increases by 1.6 times. Particular attention is paid to the use of new materials, such as nanostructures and carbon nanotubes, as well as promising technologies, such as photonic enhancement of thermionic processes. The analysis of the results showed that the photonic enhancement of the electron yield due to illumination is greater in p-type silicon, as predicted by theoretical models. The thermionic current increases by 1.7 times compared to silicon. The distance between the quasi-Fermi level and the Fermi level in n-type silicon is less than this distance in p-type silicon. As a consequence, the number of electrons in the conduction band is smaller. Methods for combating the space charge effect and optimizing the configuration of energy conversion systems are discussed.

Observation of Electrical Alignment Signatures in an Isolated Thunderstorm by Dual‐Polarized Phased Array Weather Radar and the Relationship With Intracloud Lightning Flash Rate

AbstractThe electrical alignment signatures of ice crystals in the middle and upper parts of a thunderstorm have a physical connection with the strong electric fields within the cloud. By taking advantage of the high spatio‐temporal resolution of an X‐band dual‐polarized multiparameter phased array radar, this paper employs negative KDP signatures to investigate the variation of electric fields in an isolated thunderstorm within its evolution, and the relationship between the negative KDP signatures and intracloud (IC) lightning activity. The results show that the radar‐inferred strong electric fields distributed in a region of about 8.5–10 km during the developing stage, then extended from about 10 km to the cloud top during the mature stage, with an increasing IC lightning flash rate before the end of the mature stage. Subsequently, the electric fields weakened associated with a large amount of IC lightning discharges. The qualitative analysis results indicate that the evolution of the radar‐inferred electric fields associated with the upper charge regions is consistent with the electrification process in the isolated thunderstorm, inferred by the IC lighting activity. In addition, there is a tendency for the increased IC lightning rate as the decrease in average composite KDP in the middle and upper layers of the thunderstorm, with a time lag of about 5.5 min between the minimum average composite KDP and the peak IC lightning rate, while a good correlation between the negative KDP volume and the IC lightning flash rate at a lag of approximately 9 min.

Targeted no-releasing L-arginine-induced hesperetin self-assembled nanoparticles for ulcerative colitis intervention

Overproduction of reactive oxygen species (ROS) plays a crucial role in initiating and advancing ulcerative colitis (UC), and the persistent cycle between ROS and inflammation accelerates disease development. Therefore, developing strategies that can effectively scavenge ROS and provide targeted intervention are crucial for the management of UC. In this study, we synthesized natural carrier-free nanoparticles (HST-Arg NPs) using the Mannich reaction and π-π stacking for the intervention of UC. HST-Arg NPs are an oral formulation that exhibit good antioxidant capabilities and gastrointestinal stability. Benefiting from the negatively charged characteristics, HST-Arg NPs can specifically accumulate in positively charged inflamed regions of the colon. Furthermore, in the oxidative microenvironment of colonic inflammation, HST-Arg NPs respond to ROS by releasing nitric oxide (NO). In mice model of UC induced by dextran sulfate sodium (DSS), HST-Arg NPs significantly mitigated colonic injury by modulating oxidative stress, lowering pro-inflammatory cytokines, and repairing intestinal barrier integrity. In summary, this convenient and targeted oral nanoparticle can effectively scavenge ROS at the site of inflammation and achieve gas intervention, offering robust theoretical support for the development of subsequent oral formulations in related inflammatory interventions. Statement of significanceNanotechnology has been extensively explored in the biomedical field, but the application of natural carrier-free nanotechnology in this area remains relatively rare. In this study, we developed a natural nanoparticle system based on hesperetin (HST), L-arginine (L-Arg), and vanillin (VA) to scavenge ROS and alleviate inflammation. In the context of ulcerative colitis (UC), the synthesized nanoparticles exhibited excellent intervention effects, effectively protecting the colon from damage. Consequently, these nanoparticles provide a promising and precise nutritional intervention strategy by addressing both oxidative stress and inflammatory pathways simultaneously, demonstrating significant potential for application.

E242-E261 region of MYC regulates liquid-liquid phase separation and tumor growth by providing negative charges

MYC is one of the most extensively studied oncogenic proteins and is closely associated with the occurrence and progression of many tumors. Previous studies have shown that MYC regulates cell fate through its liquid-liquid phase separation (LLPS) mechanism, which is dependent on two disordered domains within its N-terminal transcriptional activation regions. In this study, we revealed that the negatively charged conserved region (E242-E261) of the MYC protein controls its condensation formation and irreversible aggregation through multivalent electrostatic interactions (MEIs). Furthermore, deletion or mutation of the E242-E261 amino acids in the MYC protein enhances the transcriptional function of MYC by altering its aggregation capacity and subsequently promoting cancer cell proliferation. The discovery of the negatively charged region and its regulatory action on the phase separation of MYC provides a new understanding on the aggregation and function of MYC.

Structural features of carrot α-tubulin predetermining the natural resistance to dinitroaniline herbicides

Aim. To explain the natural resistance of Daucus carota L. to dinitroaniline herbicides. To clarify features of the carrot α-tubulin that may affect formation of the ligand-protein complex based on the structural and electrostatic analysis of the ligand-binding site. Methods. Reconstruction of the spatial structure of α-tubulin from D. carota and Toxoplasma gondii using profile (Swiss-Model) and de-novo (AlphaFold2) modeling. Molecular dynamics (MD) simulations of the built 3D-models in Gromacs. Analysis of the molecular electrostatics with PDB2PQR/APBS tools. Visualization and analysis of molecular structures in PyMOL. Results. It has been shown that along with the typical positive charge of the dinitroaniline-binding pocket, all isotypes of carrot α-tubulin demonstrate negatively charged regions that may cause conflicts with the nitro-groups of the ligands. Also, the MD-stable negatively charged "bridge" between Cys316 and the aryl-fragment of Phe255 was observed in all α-tubulin isotypes. In our opinion, it not only competes with the cyclic fragment of dinitroanilines, but overall prevent the opening of the site pocket in carrot α-tubulin. Conclusions. It was clarified that natural resistance of D. carota to dinitroaniline herbicides may be associated with steric and electrostatic conflicts observed in in all α-tubulin isotypes. In our opinion, it prevents interaction with dinitroaniline compounds at the stage of primary site recognition on the early stages of protein-ligand complex formation.