Ligand profile
AUJ
Ligand co-crystallized with a similar protein (Protein Data Bank).
Bound to: VK055_2490 — acetolactate synthase, large subunit, biosynthetic type
Identifiers
Database identifiers and provenance.
- Ligand ID
AUJ- PDB
5wkc- UniProt (similar protein)
P07342- Target protein
- VK055_2490
Chemical representations
Canonical representations for cheminformatics workflows.
Cc1ncc(c(n1)N)C[N]2=C(SC(=C2C)CCOP(=O)(O)OP(=O)(O)O)[C@@](C)(O)OOCc1ncc(c(n1)N)C[N]2=C(SC(=C2C)CCOP(=O)(O)OP(=O)(O)O)[C@@](C)(O)OO
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
- PF02775' 'PF02776
External resources
Open this ligand in third-party databases and cheminformatics tools.
- PDB RCSB ligand AUJ →
- PDB RCSB structure 5wkc →
- UniProt UniProt P07342 (homolog) →
- PubChem PubChem (by SMILES) →
- Cheminformatics SwissADME prediction →
- Cheminformatics SwissTargetPrediction →
- Web Google Scholar (search “AUJ”) →
Other ligands for this protein
Quick navigation to other ligands bound to VK055_2490.
PDB 36
Ligands co-crystallized with this protein (structural evidence).
ChEMBL 36
Compounds with measured inhibitory activity on this target (higher pchembl = more potent).
ZINC 50
Virtual screening candidates selected by structural similarity to known actives (Tanimoto ≥ 0.5).