foldseek

Search protein structures against PDB and AlphaFold databases with Foldseek.

151|20|Updated Jan 15, 2026
One-click install
npx skills add https://github.com/adaptyvbio/protein-design-skills --skill foldseek
Or copy as Structured Prompt for Agent
Please help me install this Agent Skill.
Skill: foldseek
Source: https://github.com/adaptyvbio/protein-design-skills/tree/main/skills/foldseek
Command: npx skills add https://github.com/adaptyvbio/protein-design-skills --skill foldseek

SYSTEM DOCUMENTATION & REQUIREMENTS

What problem does it solve?

This skill automates structure similarity search for proteins using Foldseek.

Core Features & Use Cases

It supports locating homologous structures, remote homologs, and clustering across large structure databases such as PDB and AlphaFold DB, enabling rapid assessment of design plausibility.

  • Structural homology search
  • Remote homolog detection
  • Clustering and similarity ranking
  • Use Case: identify designs with desired fold similarity to known structures

Quick Start

Use Foldseek to search a query structure against a database: foldseek easy-search query.pdb pdb100 results.m8 tmp/ --format-output query,target,pident,alnlen,evalue,bits

Frequently Asked Questions about foldseek

High-intent search queries and answers about installing and using this skill.

FAQPage Schema
How do I search for structural homologs in AlphaFold and PDB databases?

Detecting remote homologs relies on protein structure similarity rather than sequence alone. Foldseek compares a query structure against large databases to identify distant evolutionary relationships that sequence-based searches often miss.

What is the best way to cluster large sets of protein structures?

The best way to cluster large sets of protein structures is by using Foldseek for rapid structural similarity ranking. It groups proteins into clusters based on fold similarity, enabling quick assessment of design plausibility across extensive structural datasets.

Do I need a local Foldseek installation to perform a structure similarity search?

You do not necessarily need a local Foldseek installation to perform a structure similarity search. The task supports both local command-line interface usage and web access, depending on your available environment and scale requirements.

Can I configure e-value and minimum sequence identity thresholds for homology searches?

You can configure e-value and minimum sequence identity thresholds for homology searches by setting specific parameters. Foldseek accepts configurable parameters such as min-seq-id and e-value to filter structural similarity results.

How does structural homology search compare to sequence-based homology detection?

A structural homology search compares 3D protein folds to identify similarities, whereas sequence-based detection relies on amino acid alignments. Using Foldseek allows you to find remote homologs across PDB and AlphaFold databases that sequence searches cannot detect.