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Related Concept Videos

Protein Digestion01:02

Protein Digestion

Protein digestion begins in the stomach, where the highly acidic environment can easily disrupt protein structure by exposing the peptide bonds of polypeptide chains. After polypeptide chains are broken into individual amino acids by a series of digestive enzymes, the amino acids are transported to the liver via the bloodstream to produce energy.
Peptide Identification Using Tandem Mass Spectrometry01:33

Peptide Identification Using Tandem Mass Spectrometry

Tandem mass spectrometry, also known as MS/MS or MS2, is an analytical technique that employs two mass analyzers. Essentially it is a series of mass spectrometers that helps isolate a particular biomolecule and then helps study its chemical properties.
This technique helps gather information regarding the protein from which the peptide was obtained and to study the peptides’ amino acid sequence. Identifying peptides from a complex mixture is an important component of the growing field of...
The Proteasome Structure01:17

The Proteasome Structure

The ubiquitin-proteasome pathway is a well-known mechanism utilized by eukaryotic cells to remove cytoplasmic proteins that are misfolded, damaged, or no longer needed. In this pathway, the protein that needs to be eliminated undergoes a process called ubiquitination, where a chain of ubiquitin molecules is attached to the 48th lysine residue of the target protein. This ubiquitin modification helps the proteasome distinguish between a target protein and a healthy protein.
The proteasome is an...

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Updated: Jun 28, 2026

Navigating the Mass Spectrometry-Based Proteomic Data Using Free Computational Tools
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Navigating the Mass Spectrometry-Based Proteomic Data Using Free Computational Tools

Published on: August 19, 2025

DigestedProteinDB: A Compact and Scalable Key-Value Database for In Silico Peptide Digestion and Mass-Based Search.

Toni Cvrljak1, Janko Diminic2, Jurica Zucko2

  • 1Faculty of Mining, Geology and Petroleum Engineering, University of Zagreb, 10000 Zagreb, Croatia.

Journal of Proteome Research
|June 26, 2026
PubMed
Summary
This summary is machine-generated.

DigestedProteinDB offers fast and compact storage for in silico-digested peptides, enabling efficient mass spectrometry analysis. This key-value database accelerates proteomics and biotyping by providing rapid access to large peptide collections.

Keywords:
RocksDBUniProtbioinformaticsin silico digestionmass spectrometrypeptide databasepeptide mass fingerprintingprotein identification

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Area of Science:

  • Bioinformatics
  • Computational Biology
  • Mass Spectrometry

Background:

  • Efficient comparison of experimental peptide masses with theoretical values is crucial for proteomics, microbial biotyping, and MS imaging.
  • These analyses require fast and scalable access to large collections of in silico-digested peptides from evolving protein databases.

Purpose of the Study:

  • To present DigestedProteinDB, a compact and high-performance key-value database for peptides generated by enzymatic in silico digestion.
  • To optimize disk footprint and accelerate mass-range queries for large-scale peptide data.

Main Methods:

  • Implementation using RocksDB, a high-performance key-value store.
  • Incorporation of optimization layers: peptide mass discretization and multistage storage compression.
  • Benchmarking using 252 million UniProtKB protein sequences, generating 5.9 billion peptides.

Main Results:

  • DigestedProteinDB requires ~250 GB disk space and 16 GB system RAM for 5.9 billion peptides.
  • Database construction takes ~2 days.
  • End-to-end mass-range queries achieve a median latency of ~7 ms per query for 10,000 samples.

Conclusions:

  • DigestedProteinDB provides a compact and high-performance resource for mass spectrometry-based applications.
  • The database can be used as a standalone resource or integrated into bioinformatics pipelines.
  • Modular design allows rapid generation of new databases for various proteases, taxonomic subsets, or digestion parameters.