Attributes
UniProt ID
Protein Name
CAI-1 autoinducer synthase
Ligand Name
PYRIDOXAL-5'-PHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NGVDGCNFYWLIFO-UHFFFAOYSA-N
SMILES
Cc1c(c(c(cn1)COP(=O)(O)O)C=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 2WK8
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Color Legend
Unassigned regionsLigand / hetero atomse2wk8A1e2wk8A2e2wk8B2e2wk8B3
ECOD domains from experimental PDB structures interacting with ligand DB00114
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9KM65 | DB00114 | PLP | 2wk8 | e2wk8A2 | A:34-286 |
| Q9KM65 | DB00114 | PLP | 2wk8 | e2wk8B3 | B:34-68,B:89-286 |
| Q9KM65 | DB00114 | PLP | 2wk9 | e2wk9A3 | A:34-286 |
| Q9KM65 | DB00114 | PLP | 2wk9 | e2wk9B3 | B:34-286 |
| Q9KM65 | DB00114 | PLP | 3hqt | e3hqtA3 | A:34-286 |
| Q9KM65 | DB00114 | PLP | 3hqt | e3hqtB2 | B:4-285 |
| Q9KM65 | DB00114 | PLP | 3kki | e3kkiA2 | A:4-285 |
| Q9KM65 | DB00114 | PLP | 3kki | e3kkiB2 | B:4-285 |