PPARγis a peroxisome proliferator-activated receptor(PPAR)family protein and is a target for type 2 diabetes(T2D).In this paper,we have performed a molecular docking analysis between ligand molecules(CID9816265,CID11...PPARγis a peroxisome proliferator-activated receptor(PPAR)family protein and is a target for type 2 diabetes(T2D).In this paper,we have performed a molecular docking analysis between ligand molecules(CID9816265,CID11608015,CID20251380,CID20251343,CID20556263,CID624491,CID42609928,and CID86287562)and PPARγto determine the ligand specificity.It also helps to understand the ligand-binding domain(LBD)activity of PPARγduring the binding of the ligand.Further,a molecular dynamics simulation study was performed to determine the ligand biding stability in the PPARγLBD.Its ligand specificity informed us about the potentiality of selecting a partial agonist.The study also shows the binding conformation of Ceramicine B having hydrogen bonding affinity with a tricyclic polar head and stabilized theβ-sheet region.On the other hand,the tricyclic polar head of nimbolide also formed hydrogen bonding(Ser342),but it shows a lesser degree of stabilization in theβ-sheet region.It shows the binding conformation of partial agonist(PPARγ)in the Pocket-II of PPARγLBD,which has a significant role in stabilizing theβ-sheet region.It might help to regulate ERK/Cdk5 mediated phosphorylation of Ser245.The study helps us understand the valid pose of a set of ligands confirmation and target protein conformation using docking and molecular dynamics study.This in silico study will also help to initiate a drug discovery process of T2D.展开更多
人类疾病的产生是遗传和环境相互作用的结果,科学家已经定位了许多与疾病相关的突变区域,其中FTO(fat mass and obesity associate)基因是近期发现与肥胖显著相关的基因。研究发现FTO基因单核苷酸多态性(single nucleotide polymorphism...人类疾病的产生是遗传和环境相互作用的结果,科学家已经定位了许多与疾病相关的突变区域,其中FTO(fat mass and obesity associate)基因是近期发现与肥胖显著相关的基因。研究发现FTO基因单核苷酸多态性(single nucleotide polymorphism,SNP)与二型糖尿病(T2D)、肥胖、癌症、阿尔茨海默症、神经元功能等多种健康问题有关,然而针对不同人群的研究结果存在差异,本文通过查阅国内外关于FTO基因的最新文章,论述FTO基因SNPs与疾病的关系,为进一步研究FTO基因功能提供参考。展开更多
Incorrect injection technique of insulin is a common problem worldwide,which can reduce the efficacy of insulin therapy and lead to poor glucose control.A cross-sectional,multiple-center survey from 44 hospitals was c...Incorrect injection technique of insulin is a common problem worldwide,which can reduce the efficacy of insulin therapy and lead to poor glucose control.A cross-sectional,multiple-center survey from 44 hospitals was conducted from Nov.2015 to Dec.2015.Non-parametric Kruskal–Wallis analysis of variance and Mann-Whitney U test were used for multi-parametric analysis.Multivariable logistic regressions were performed to identify the factors associated with independent variables.Overall,a single needle was used at an average of 3.79 times,with the highest of 60 times.Analysis across all study participants showed that the frequency of a single needle was positively correlated with age（P = 0.029）,duration of diabetes（P≤0.001） and number of complications（P≤0.001）.Multivariable logistic regressions analysis of insulin pen needle reuse and needle compliance showed that age,income,education,marital status,duration of diabetes,quality of life and cost of drug were significantly related to needle reuse.From this survey,we found that reuse of insulin pen needle was common in China.Frequency of needle reuse was related to the patients＇ demographic characteristics（income level,age,region,education,employment status and self-care）,health-related variables（duration of diabetes,number of complications and EQ-5 D index scores） and utilization of health services（clinical visits,hospitalization and cost of medications）.展开更多
基金supported by Hallym University Research Fund and by Basic Science Research Program through the National Research Foundation of Korea(NRF)funded by the Ministry of Education(NRF-2020R1C1C1008694&NRF-2020R1I1A3074575).
文摘PPARγis a peroxisome proliferator-activated receptor(PPAR)family protein and is a target for type 2 diabetes(T2D).In this paper,we have performed a molecular docking analysis between ligand molecules(CID9816265,CID11608015,CID20251380,CID20251343,CID20556263,CID624491,CID42609928,and CID86287562)and PPARγto determine the ligand specificity.It also helps to understand the ligand-binding domain(LBD)activity of PPARγduring the binding of the ligand.Further,a molecular dynamics simulation study was performed to determine the ligand biding stability in the PPARγLBD.Its ligand specificity informed us about the potentiality of selecting a partial agonist.The study also shows the binding conformation of Ceramicine B having hydrogen bonding affinity with a tricyclic polar head and stabilized theβ-sheet region.On the other hand,the tricyclic polar head of nimbolide also formed hydrogen bonding(Ser342),but it shows a lesser degree of stabilization in theβ-sheet region.It shows the binding conformation of partial agonist(PPARγ)in the Pocket-II of PPARγLBD,which has a significant role in stabilizing theβ-sheet region.It might help to regulate ERK/Cdk5 mediated phosphorylation of Ser245.The study helps us understand the valid pose of a set of ligands confirmation and target protein conformation using docking and molecular dynamics study.This in silico study will also help to initiate a drug discovery process of T2D.
文摘人类疾病的产生是遗传和环境相互作用的结果,科学家已经定位了许多与疾病相关的突变区域,其中FTO(fat mass and obesity associate)基因是近期发现与肥胖显著相关的基因。研究发现FTO基因单核苷酸多态性(single nucleotide polymorphism,SNP)与二型糖尿病(T2D)、肥胖、癌症、阿尔茨海默症、神经元功能等多种健康问题有关,然而针对不同人群的研究结果存在差异,本文通过查阅国内外关于FTO基因的最新文章,论述FTO基因SNPs与疾病的关系,为进一步研究FTO基因功能提供参考。
文摘Incorrect injection technique of insulin is a common problem worldwide,which can reduce the efficacy of insulin therapy and lead to poor glucose control.A cross-sectional,multiple-center survey from 44 hospitals was conducted from Nov.2015 to Dec.2015.Non-parametric Kruskal–Wallis analysis of variance and Mann-Whitney U test were used for multi-parametric analysis.Multivariable logistic regressions were performed to identify the factors associated with independent variables.Overall,a single needle was used at an average of 3.79 times,with the highest of 60 times.Analysis across all study participants showed that the frequency of a single needle was positively correlated with age（P = 0.029）,duration of diabetes（P≤0.001） and number of complications（P≤0.001）.Multivariable logistic regressions analysis of insulin pen needle reuse and needle compliance showed that age,income,education,marital status,duration of diabetes,quality of life and cost of drug were significantly related to needle reuse.From this survey,we found that reuse of insulin pen needle was common in China.Frequency of needle reuse was related to the patients＇ demographic characteristics（income level,age,region,education,employment status and self-care）,health-related variables（duration of diabetes,number of complications and EQ-5 D index scores） and utilization of health services（clinical visits,hospitalization and cost of medications）.
