Identification of cholinesterases inhibitors from flavonoids derivatives for possible treatment of Alzheimer's disease: In silico and in vitro approaches [0.03%]
基于黄酮类化合物的胆碱酯酶抑制剂的虚拟筛选及其体外活性评价：阿尔茨海默症治疗的潜在药物研究
Morteza Sadeghi,Seyedehmasoumeh Seyedebrahimi,Mustafa Ghanadian et al.
Morteza Sadeghi et al.
Nowadays, one of the methods to prevent the progress of Alzheimer's disease (AD) is to prescribe compounds that inhibit the acetylcholinesterase (AChE) and butyrylcholinesterase (BChE) enzymes. Researchers are actively pursuing compounds, p...
Experimental methods to study the structure and dynamics of intrinsically disordered regions in proteins [0.03%]
研究蛋白质内在无序区域结构和动力学的实验方法
Snigdha Maiti,Aakanksha Singh,Tanisha Maji et al.
Snigdha Maiti et al.
Eukaryotic proteins often feature long stretches of amino acids that lack a well-defined three-dimensional structure and are referred to as intrinsically disordered proteins (IDPs) or regions (IDRs). Although these proteins challenge conven...
Alternate conformations found in protein structures implies biological functions: A case study using cyclophilin A [0.03%]
蛋白质结构中发现的构象转换具有生物学功能：以亲环素A为例的功能构象研究
Chandrasekaran Palaniappan,Santhosh Rajendran,Kanagaraj Sekar
Chandrasekaran Palaniappan
Protein dynamics linked to numerous biomolecular functions, such as ligand binding, allosteric regulation, and catalysis, must be better understood at the atomic level. Reactive atoms of key residues drive a repertoire of biomolecular funct...
ANN based prediction of ligand binding sites outside deep cavities to facilitate drug designing [0.03%]
基于ANN的浅表疏水药物结合位点预测以促进新药设计
Kalpana Singh,Yashpal Singh Malik
Kalpana Singh
The ever-changing environmental conditions and pollution are the prime reasons for the onset of several emerging and re-merging diseases. This demands the faster designing of new drugs to curb the deadly diseases in less waiting time to cur...
Bacterial selenocysteine synthase structure revealed by single-particle cryoEM [0.03%]
单颗粒冷冻电镜解析细菌硒半胱氨酸合成酶结构
Vitor Hugo Balasco Serrão,Karine Minari,Humberto D&#x;Muniz Pereira et al.
Vitor Hugo Balasco Serrão et al.
The 21st amino acid, selenocysteine (Sec), is synthesized on its dedicated transfer RNA (tRNASec). In bacteria, Sec is synthesized from Ser-tRNA[Ser]Sec by Selenocysteine Synthase (SelA), which is a pivotal enzyme in the biosynthesis of Sec...
Back in time to the Gly-rich prototype of the phosphate binding elementary function [0.03%]
时光倒流回到富甘氨酸的多磷酸盐结合功能原型阶段
Zejun Zheng,Alexander Goncearenco,Igor N Berezovsky
Zejun Zheng
Binding of nucleotides and their derivatives is one of the most ancient elementary functions dating back to the Origin of Life. We review here the works considering one of the key elements in binding of (di)nucleotide-containing ligands - p...
Benjamin M Scott,Kevin Koh,Gregory D Rix
Benjamin M Scott
Phytase enzymes are a crucial component of the natural phosphorus cycle, as they help make phosphate bioavailable by releasing it from phytate, the primary reservoir of organic phosphorus in grain and soil. Phytases also comprise a signific...
Computational insights into the circular permutation roles on ConA binding and structural stability [0.03%]
计算洞察：环形排列在ConA结合和结构稳定性中的作用
Vinicius J S Osterne,Vanir R Pinto-Junior,Messias V Oliveira et al.
Vinicius J S Osterne et al.
The mechanisms behind Concanavalin A (ConA) circular permutation have been under investigation since 1985. Although a vast amount of information is available about this lectin and its applications, the exact purpose of its processing remain...
Molecular forces driving protein complexation of lentil and whey proteins: Structure-function relationships of trehalose-conjugated protein complexes on protein digestibility and solubility [0.03%]
半乳糖衍生物驱动的绿豆蛋白和乳蛋白复合物相互作用及海藻糖结合对蛋白质消化率和溶解度的影响及其结构功能关系研究
Mohammad Alrosan,Ali Madi Almajwal,Ali Al-Qaisi et al.
Mohammad Alrosan et al.
Plant-based proteins are often associated with a range of health benefits. Most research primarily investigates pea and soy proteins, while lentil proteins received minimal attention. This study evaluates the effect of protein complexation ...
Molecular structural modeling and physical characteristics of anti-breast cancer drugs via some novel topological descriptors and regression models [0.03%]
基于一些新型拓扑描述符和回归模型的抗乳腺癌药物分子结构建模及物理属性研究
Summeira Meharban,Asad Ullah,Shahid Zaman et al.
Summeira Meharban et al.
Research is continuously being pursued to treat cancer patients and prevent the disease by developing new medicines. However, experimental drug design and development is a costly, time-consuming, and challenging process. Alternatively, comp...