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Cortexa research tool·structure·pdbe_search
PDBeSearch Get Compound
Get PDB ligand/compound information by compound ID from PDBe. Returns chemical name, formula, molecular weight, InChI, InChI key, SMILES, and systematic names. Useful for looking up small molecules that co-crystallize with proteins. Example: 'ATP' returns adenosine-5'-triphosphate (C10H16N5O13P3, MW 507.18); 'HEM' returns protoporphyrin IX containing iron.
AvailableCortexa
Schema
JSON Schema the agent (or your API call) must match.
JSON · 12 lines · 318 chars
Examples (1)
Default PDBeSearch Get Compound call
public-safeinput
JSON · 3 lines · 30 chars
Expected response keys: success
Anonymous-safe example. Rate-limited; no sign-in required.
Identifiers
- Catalog ID
- tu_PDBeSearch_get_compound
- Tool name
- PDBeSearch_get_compound
- Added
- 2026-04-30 22:47Z
- Tags
- tooluniverse