Ligand profile
08T
Ligand co-crystallized with a similar protein (Protein Data Bank).
Bound to: KP13_05447 — Psp operon transcriptional activator
Identifiers
Database identifiers and provenance.
- Ligand ID
08T- PDB
4lzz- UniProt (similar protein)
O67198- Target protein
- KP13_05447
Chemical representations
Canonical representations for cheminformatics workflows.
[Be](OP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O)(F)(F)F[Be](OP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O)(F)(F)F
Provenance
Annotation context from LigQ_2, the internal Target step that collects PDB, ChEMBL, and ZINC ligand evidence.
- Method
- LigQ nearest_k
- Source
- PDB
- Binding sites
- PF00158
External resources
Open this ligand in third-party databases and cheminformatics tools.
- PDB RCSB ligand 08T →
- PDB RCSB structure 4lzz →
- UniProt UniProt O67198 (homolog) →
- PubChem PubChem (by SMILES) →
- Cheminformatics SwissADME prediction →
- Cheminformatics SwissTargetPrediction →
- Web Google Scholar (search “08T”) →
Other ligands for this protein
Quick navigation to other ligands bound to KP13_05447.
PDB 5
Ligands co-crystallized with this protein (structural evidence).
ZINC 50
Virtual screening candidates selected by structural similarity to known actives (Tanimoto ≥ 0.5).