Morpheus3D-Database / README.md
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metadata
license: apache-2.0
language:
  - en
pretty_name: Morpheus-3D Database
tags:
  - protein
  - protein-structure
  - structural-biology
  - bioinformatics
  - foldseek
  - 3di
  - alphafold
  - pdb
  - metamorphic-proteins
  - machine-learning
  - dataset
size_categories:
  - 1M<n<10M

Morpheus-3D Database

Overview

The Morpheus-3D Database is a comprehensive sequence–structure resource developed to support the Morpheus-3D framework for protein fold-switching prediction and structural diversity analysis. It integrates experimentally determined structures from the Protein Data Bank (PDB) and high-confidence protein structure predictions from the AlphaFold Protein Structure Database into a unified, searchable repository.

Each protein entry contains multiple complementary structural representations, enabling efficient sequence-to-structure mapping, structural alphabet analysis, and rapid retrieval of protein fragments for computational structural biology and machine learning applications.

This repository contains the databases used by the Morpheus-3D software and web server.


Dataset Statistics

Property Value
Total protein entries 1,770,688
Total residues 4,101,250,302
Minimum sequence length 5 amino acids
Maximum sequence length 29,668 amino acids
Mean sequence length 2,316.19 amino acids
Median sequence length 1,364 amino acids

Repository Contents

Morpheus3D_sequence_database.zip
Morpheus3D_database_sqlite.zip
README.md
LICENSE

File Descriptions

Morpheus3D_sequence_database.zip

Compressed archive containing the complete Morpheus-3D protein sequence database.

After extraction:

Morpheus3D_database.fasta

Each protein record contains:

  • Protein identifier
  • Amino acid sequence
  • DSSP secondary structure annotation
  • Foldseek 3Di structural alphabet sequence
  • Residue-wise AlphaFold pLDDT confidence scores (when available)

Record Format

>Protein_ID
AMINO_ACID_SEQUENCE
DSSP_SEQUENCE
3DI_SEQUENCE
[pLDDT_VALUES]

Morpheus3D_database_sqlite.zip

Compressed archive containing the indexed SQLite database used by the Morpheus-3D prediction pipeline.

After extraction:

Morpheus3D_database.sqlite

The SQLite database provides:

  • Fast protein sequence lookup
  • Efficient k-mer indexing
  • Rapid structural fragment retrieval
  • High-performance database queries
  • Direct compatibility with the Morpheus-3D software and web server

Data Sources

The Morpheus-3D Database integrates protein structural information from:

  • Protein Data Bank (PDB)
  • AlphaFold Protein Structure Database

Protein structures were processed to generate:

  • Amino acid sequences
  • DSSP secondary structure assignments
  • Foldseek 3Di structural alphabet representations
  • Residue-wise AlphaFold pLDDT confidence scores (where available)

Applications

The Morpheus-3D Database supports a wide range of computational structural biology and machine learning applications, including:

  • Protein fold-switching prediction
  • Structural diversity analysis
  • Protein language model development
  • Foldseek 3Di structural alphabet research
  • Sequence–structure relationship studies
  • Protein engineering
  • Computational structural biology
  • Machine learning on protein structural representations

Download

This repository contains two downloadable archives:

Archive Description
Morpheus3D_sequence_database.zip FASTA-based protein sequence database containing amino acid sequences, DSSP annotations, Foldseek 3Di structural alphabet sequences, and residue-wise AlphaFold pLDDT confidence scores.
Morpheus3D_database_sqlite.zip Indexed SQLite database for high-performance sequence lookup, k-mer indexing, and rapid integration with the Morpheus-3D software and web server.

Download and extract the archive(s) required for your application before using them with the Morpheus-3D software.


Citation

If you use the Morpheus-3D Database or its derived structural representations in your research, please cite:

Sreeharsh Kuniyil, Vijay Subramanian, Akanksha Arun, Anand Lakshmanan, Ashok Sekhar, Anand Srivastava. Morpheus-3D: Structural Diversity-Guided Detection and Localization of Protein Fold Switching. bioRxiv (2026). https://doi.org/10.64898/2026.08.16.745091

Contact

For questions, bug reports, or feature requests, please open an issue in this repository or contact the corresponding authors of the Morpheus-3D project.


Acknowledgements

The Morpheus-3D Database was developed as part of the Morpheus-3D framework for large-scale prediction and localization of protein fold-switching behavior using sequence-derived structural diversity. It is intended to facilitate reproducible research in structural bioinformatics, protein science, and machine learning.