Attributes
UniProt ID
Protein Name
Beta-galactosidase
Ligand Name
8-[2-[(E)-2-[4-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]ethenyl]-3,3-dimethyl-indol-1-ium-1-yl]octanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XYRPYNRUMDVKEZ-ZUPFTECCSA-O
SMILES
CC1(c2ccccc2[N+](=C1C=Cc3ccc(cc3)OC4C(C(C(C(O4)CO)O)O)O)CCCCCCCC(=O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 7BRS
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Color Legend
Unassigned regionsLigand / hetero atomse7brsA1e7brsA2e7brsA3e7brsA4e7brsA5e7brsB1e7brsB2e7brsB3e7brsB4e7brsB5e7brsC1e7brsC2e7brsC3e7brsC4e7brsC5e7brsD1e7brsD2e7brsD3e7brsD4e7brsD5
ECOD domains from experimental PDB structures interacting with ligand F4X
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P00722 | n/a | F4X | 7brs | e7brsA2 | A:3-219 |
| P00722 | n/a | F4X | 7brs | e7brsA3 | A:731-1023 |
| P00722 | n/a | F4X | 7brs | e7brsA4 | A:334-625 |
| P00722 | n/a | F4X | 7brs | e7brsB3 | B:731-1023 |
| P00722 | n/a | F4X | 7brs | e7brsB4 | B:334-625 |
| P00722 | n/a | F4X | 7brs | e7brsB5 | B:3-219 |
| P00722 | n/a | F4X | 7brs | e7brsC1 | C:731-1023 |
| P00722 | n/a | F4X | 7brs | e7brsC2 | C:4-219 |
| P00722 | n/a | F4X | 7brs | e7brsC5 | C:334-625 |
| P00722 | n/a | F4X | 7brs | e7brsD1 | D:3-219 |
| P00722 | n/a | F4X | 7brs | e7brsD2 | D:334-625 |
| P00722 | n/a | F4X | 7brs | e7brsD5 | D:731-1023 |