Attributes
UniProt ID
Protein Name
Phenylacetate-coenzyme A ligase
Ligand Name
COENZYME A
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RGJOEKWQDUBAIZ-IBOSZNHHSA-N
SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4R1L
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Color Legend
Unassigned regionsLigand / hetero atomse4r1lA1e4r1lA2e4r1lA3e4r1lB1e4r1lB3e4r1lB4e4r1lC2e4r1lC3e4r1lC4e4r1lD1e4r1lD3e4r1lD4
ECOD domains from experimental PDB structures interacting with ligand DB01992
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q8AAN6 | DB01992 | COA | 4r1l | e4r1lA1 | A:0-256 |
| Q8AAN6 | DB01992 | COA | 4r1l | e4r1lA2 | A:328-434 |
| Q8AAN6 | DB01992 | COA | 4r1l | e4r1lC2 | C:328-433 |
| Q8AAN6 | DB01992 | COA | 4r1l | e4r1lC3 | C:0-257 |
| Q8AAN6 | DB01992 | COA | 4rvn | e4rvnA2 | A:328-434 |
| Q8AAN6 | DB01992 | COA | 4rvn | e4rvnA3 | A:0-257 |
| Q8AAN6 | DB01992 | COA | 4rvn | e4rvnC1 | C:328-433 |
| Q8AAN6 | DB01992 | COA | 4rvn | e4rvnC3 | C:0-257 |