Attributes
UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
RIFAMPICIN
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JQXXHWHPUNPDRT-WLSIYKJHSA-N
SMILES
Cc1c(c2c3c4c1OC(C4=O)(OC=CC(C(C(C(C(C(C(C(C=CC=C(C(=O)Nc(c2O)c(c3O)C=NN5CCN(CC5)C)C)C)O)C)O)C)OC(=O)C)C)OC)C)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 3AOB
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 atomse3aobA10e3aobA11e3aobA12e3aobA13e3aobA14e3aobA15e3aobA7e3aobA9e3aobB10e3aobB11e3aobB12e3aobB13e3aobB14e3aobB15e3aobB7e3aobB9e3aobC10e3aobC11e3aobC12e3aobC13e3aobC14e3aobC15e3aobC7e3aobC9
ECOD domains from experimental PDB structures interacting with ligand DB01045
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P31224 | DB01045 | RFP | 3aob | e3aobC12 | C:38-134 |
| P31224 | DB01045 | RFP | 3aob | e3aobC13 | C:553-659 |
| P31224 | DB01045 | RFP | 3aob | e3aobC14 | C:660-709,C:798-844 |
| P31224 | DB01045 | RFP | 3aob | e3aobC9 | C:710-797 |
| P31224 | DB01045 | RFP | 3aod | e3aodC12 | C:38-134 |
| P31224 | DB01045 | RFP | 3aod | e3aodC13 | C:553-659 |
| P31224 | DB01045 | RFP | 3aod | e3aodC14 | C:660-709,C:798-844 |
| P31224 | DB01045 | RFP | 3aod | e3aodC9 | C:710-797 |