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利用衰减全反射傅里叶变换红外光谱(ATR-FTIR)及化学计量学结合血脂谱、人体测量学和促炎生物标志物的多变量分析来鉴别血脂异常类型。

Discrimination of dyslipidemia types with ATR-FTIR spectroscopy and chemometrics associated with multivariate analysis of the lipid profile, anthropometric, and pro-inflammatory biomarkers.

作者信息

de Souza Nikolas Mateus Pereira, Machado Brenda Hunter, Koche Andreia, da Silva Furtado Lucia Beatriz Fernandes, Becker Débora, Corbellini Valeriano Antonio, Rieger Alexandre

机构信息

Department of Life Sciences, University of Santa Cruz do Sul, Santa Cruz do Sul, RS, Brazil.

International Affairs, International University Centre, Santa Cruz do Sul, RS, Brazil.

出版信息

Clin Chim Acta. 2023 Feb 1;540:117231. doi: 10.1016/j.cca.2023.117231. Epub 2023 Jan 20.

Abstract

BACKGROUND

Obesity, dyslipidemia, and low-grade inflammatory state form a triad of self-sustaining metabolic dysfunction. Attenuated total reflection Fourier transform infrared (ATR-FTIR) spectroscopy is a simple, rapid, and non-destructive technique that generates spectral fingerprints of biomolecules that can be correlated with metabolic changes. We verified the efficiency of ATR-FTIR spectroscopy in blood plasma (n = 74) to discriminate the types of dyslipidemias and suggest metabolic inflammatory changes.

METHODS

Principal Component Analysis (PCA) was performed on the biochemical and anthropometric data to verify whether the dyslipidemia types share a similar biochemical profile plausible of discrimination in chemometric modeling. To discriminate the types of dyslipidemias based on spectral data, Orthogonal Partial Least-Squares Discriminant Analysis (OPLS-DA) was used and validated with leave-one-out cross-validation.

RESULTS

Although no significant difference was obtained between the types of dyslipidemia and normal subjects by CRP, leptin, and cfDNA, there was a significant difference between normal subjects vs combined hyperlipidemia (CH) + hypercholesterolemia (HCL) + hypertriglyceridemia (HTG) (p < 0.05) by the 1245 cm peak [ν(PO)] (possible indication of chronic inflammation by increased cfDNA). The area under the curve of the region between 1770 and 1720 cm was significantly increased for CH in relation to other dyslipidemias and normal subjects. Furthermore, there were significant differences for the main representative peaks of lipids, proteins, carbohydrates, and nucleic acids between the types of dyslipidemias and between the types of dyslipidemias and normal subjects. The OPLS-DA model achieved 100 % accuracy with 1 latent variable and Standard Error of Cross-Validation (SECV) < 0.004 for all types of dyslipidemia  and the control group.

CONCLUSIONS

Our results suggest that ATR-FTIR spectroscopy associated with chemometric modeling is a plausible applicant for screening the types of dyslipidemias. However, more extensive studies should be conducted to verify the real applicability in clinical analysis laboratories or medical clinics.

摘要

背景

肥胖、血脂异常和低度炎症状态构成了一个自我维持的代谢功能障碍三联征。衰减全反射傅里叶变换红外光谱(ATR-FTIR)是一种简单、快速且无损的技术,可生成生物分子的光谱指纹,这些指纹可与代谢变化相关联。我们验证了ATR-FTIR光谱在血浆(n = 74)中区分血脂异常类型并提示代谢性炎症变化的效率。

方法

对生化和人体测量数据进行主成分分析(PCA),以验证血脂异常类型在化学计量学建模中是否具有相似的可区分生化特征。为了基于光谱数据区分血脂异常类型,使用了正交偏最小二乘判别分析(OPLS-DA)并通过留一法交叉验证进行了验证。

结果

尽管通过CRP、瘦素和cfDNA在血脂异常类型与正常受试者之间未获得显著差异,但在正常受试者与合并高脂血症(CH)+高胆固醇血症(HCL)+高甘油三酯血症(HTG)之间,通过1245 cm峰[ν(PO)](cfDNA增加可能提示慢性炎症)存在显著差异(p < 0.05)。与其他血脂异常和正常受试者相比,CH在1770至1720 cm区域的曲线下面积显著增加。此外,血脂异常类型之间以及血脂异常类型与正常受试者之间在脂质、蛋白质、碳水化合物和核酸的主要代表性峰方面存在显著差异。OPLS-DA模型对所有类型的血脂异常和对照组在1个潜在变量下实现了100%的准确率,交叉验证标准误差(SECV)< 0.004。

结论

我们的结果表明,与化学计量学建模相关的ATR-FTIR光谱是筛选血脂异常类型的一个合理候选方法。然而,应进行更广泛的研究以验证其在临床分析实验室或医疗诊所中的实际适用性。

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