pdb-database
Installation
SKILL.md
When to Use
Use this skill when you need to:
- Find protein/nucleic acid 3D structures by keywords, organism, experimental method, or resolution.
- Identify related structures via sequence similarity (e.g., homolog search for modeling).
- Identify related structures via 3D structure similarity (e.g., fold-level comparisons).
- Download coordinates (PDB/mmCIF) for downstream analysis, visualization, docking, or modeling.
- Run batch retrieval of metadata/coordinates to feed pipelines in drug discovery, protein engineering, or structural bioinformatics.
Key Features
- Text and attribute-based search over RCSB PDB entries.
- Sequence similarity search with configurable thresholds (e-value, identity).
- Structure similarity search using an existing entry as a query.
- Programmatic metadata retrieval via the RCSB Data API (schema-based or GraphQL).
- Direct coordinate downloads in PDB and mmCIF formats.
- Batch processing patterns for multiple PDB IDs.