Attributes
UniProt ID
Protein Name
4-coumarate--CoA ligase 2
Ligand Name
5'-O-[(R)-hydroxy{[(2E)-3-(5-methoxy-4-oxocyclohexa-1,5-dien-1-yl)prop-2-enoyl]oxy}phosphoryl]adenosine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
DTAKVQMQJSRZPC-NLGGRGNSSA-N
SMILES
COC1=CC(=CCC1=O)C=CC(=O)OP(=O)(O)OCC2C(C(C(O2)n3cnc4c3ncnc4N)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: 5BSV
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse5bsvA1e5bsvA2e5bsvA3e5bsvA4
ECOD domains from experimental PDB structures interacting with ligand 4UW
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O24146 | n/a | 4UW | 5bsv | e5bsvA1 | A:178-351 |
| O24146 | n/a | 4UW | 5bsv | e5bsvA2 | A:438-536 |
| O24146 | n/a | 4UW | 5bsv | e5bsvA4 | A:352-437 |
| O24146 | n/a | 4UW | 5bsw | e5bswA1 | A:359-434 |
| O24146 | n/a | 4UW | 5bsw | e5bswA2 | A:435-534 |
| O24146 | n/a | 4UW | 5bsw | e5bswA3 | A:176-358 |
| O24146 | n/a | 4UW | 5bsw | e5bswB1 | B:437-533 |
| O24146 | n/a | 4UW | 5bsw | e5bswB2 | B:178-350 |
| O24146 | n/a | 4UW | 5bsw | e5bswB4 | B:351-436 |