Centre of Biological Engineering, University of Minho, Campus of Gualtar, Braga, Portugal.
LABBELS, Associate Laboratory, Braga/Guimarães, Portugal.
PLoS Comput Biol. 2024 Oct 10;20(10):e1012506. doi: 10.1371/journal.pcbi.1012506. eCollection 2024 Oct.
Vitis vinifera, also known as grapevine, is widely cultivated and commercialized, particularly to produce wine. As wine quality is directly linked to fruit quality, studying grapevine metabolism is important to understand the processes underlying grape composition. Genome-scale metabolic models (GSMMs) have been used for the study of plant metabolism and advances have been made, allowing the integration of omics datasets with GSMMs. On the other hand, Machine learning (ML) has been used to analyze and integrate omics data, and while the combination of ML with GSMMs has shown promising results, it is still scarcely used to study plants. Here, the first GSSM of V. vinifera was reconstructed and validated, comprising 7199 genes, 5399 reactions, and 5141 metabolites across 8 compartments. Tissue-specific models for the stem, leaf, and berry of the Cabernet Sauvignon cultivar were generated from the original model, through the integration of RNA-Seq data. These models have been merged into diel multi-tissue models to study the interactions between tissues at light and dark phases. The potential of combining ML with GSMMs was explored by using ML to analyze the fluxomics data generated by green and mature grape GSMMs and provide insights regarding the metabolism of grapes at different developmental stages. Therefore, the models developed in this work are useful tools to explore different aspects of grapevine metabolism and understand the factors influencing grape quality.
酿酒葡萄,又称葡萄藤,广泛种植和商业化,特别是用于生产葡萄酒。由于葡萄酒的质量直接与果实的质量相关,因此研究葡萄藤的新陈代谢对于了解葡萄成分的形成过程非常重要。基因组规模代谢模型(GSMMs)已被用于植物代谢的研究,并取得了进展,允许将组学数据集与 GSMMs 进行整合。另一方面,机器学习(ML)已被用于分析和整合组学数据,虽然 ML 与 GSMMs 的结合已经显示出了有前途的结果,但它在植物研究中仍然很少使用。在这里,首次构建和验证了酿酒葡萄的 GSMM,该模型包含 7199 个基因、5399 个反应和 5141 种代谢物,分布在 8 个隔室中。通过整合 RNA-Seq 数据,从原始模型生成了赤霞珠品种的茎、叶和浆果的组织特异性模型。这些模型已经合并到昼夜多组织模型中,以研究光暗阶段组织之间的相互作用。通过使用 ML 分析绿色和成熟葡萄 GSMM 产生的通量组学数据,并提供有关不同发育阶段葡萄代谢的见解,探索了 ML 与 GSMMs 结合的潜力。因此,本工作中开发的模型是探索葡萄藤代谢不同方面和了解影响葡萄质量的因素的有用工具。