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Lactylation prediction models based on protein sequence and structural feature fusion.

Ye-Hong Yang1, Jun-Tao Yang1,2, Jiang-Feng Liu1,2

  • 1State Key Laboratory of Common Mechanism Research for Major Diseases, Department of Biochemistry and Molecular Biology, Institute of Basic Medical Sciences, Chinese Academy of Medical Sciences & Peking Union Medical College, No.5, Dongdan 3, Dongcheng District Municipality of Beijing, Beijing 100005, China.

Briefings in Bioinformatics
|February 22, 2024
PubMed
Summary

Lysine lactylation (Kla) prediction is improved by combining sequence and 3D structural features. New models, ABFF-Kla and EBFF-Kla, offer better performance than sequence-only methods for Kla site identification.

Keywords:
automatic feature extractiondeep learningfeature fusionlysine lactylationresidue contact map

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Area of Science:

  • Biochemistry
  • Computational Biology
  • Genomics

Background:

  • Lysine lactylation (Kla) is a crucial posttranslational modification impacting cellular functions like glycolysis and macrophage polarization.
  • Kla is increasingly recognized for its role in tumor cell metabolism, particularly the Warburg effect.

Purpose of the Study:

  • To develop an automated method for extracting 3D structural features of Kla sites, mitigating manual bias.
  • To establish robust Kla prediction frameworks integrating sequence and structural data.

Main Methods:

  • A natural language processing approach was used for automatic 3D structural feature extraction of Kla sites.
  • Two frameworks, Attention-based feature fusion Kla model (ABFF-Kla) and Embedding-based feature fusion Kla model (EBFF-Kla), were developed.
  • These models integrate protein sequence and spatial structure features using attention and embedding layers.

Main Results:

  • Models integrating both sequence and spatial structure features (ABFF-Kla and EBFF-Kla) demonstrated superior predictive performance.
  • The proposed methods outperformed models relying solely on sequence features for Kla prediction.
  • The study provides a novel approach for automated protein structural feature extraction.

Conclusions:

  • Feature fusion of protein sequence and spatial structure significantly enhances Kla prediction accuracy.
  • The developed ABFF-Kla and EBFF-Kla frameworks offer a flexible and effective approach for Kla site identification.
  • This work contributes automated methods for structural feature extraction and Kla prediction, with code publicly available.