Attributes
UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
3-chloranyl-2-piperazin-1-yl-quinoline
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JJZVQFQJCHXCFQ-UHFFFAOYSA-N
SMILES
c1ccc2c(c1)cc(c(n2)N3CCNCC3)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 7OUK
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Color Legend
Unassigned regionsLigand / hetero atomse7oukA1e7oukA2e7oukA3e7oukA4e7oukA5e7oukA6e7oukA7e7oukA8e7oukB1e7oukB2e7oukB3e7oukB4e7oukB5e7oukB6e7oukB7e7oukB8e7oukC1e7oukC2e7oukC3e7oukC4e7oukC5e7oukC6e7oukC7e7oukC8e7oukD1e7oukE1
ECOD domains from experimental PDB structures interacting with ligand 1K8
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P31224 | n/a | 1K8 | 7ouk | e7oukA6 | A:1-37,A:331-504 |
| P31224 | n/a | 1K8 | 7ouk | e7oukA8 | A:505-566,A:869-1042 |
| P31224 | n/a | 1K8 | 7ouk | e7oukB5 | B:182-273 |
| P31224 | n/a | 1K8 | 7ouk | e7oukC7 | C:725-812 |
| P31224 | n/a | 1K8 | 7oum | e7oumA5 | A:506-566,A:869-1041 |
| P31224 | n/a | 1K8 | 7oum | e7oumA6 | A:1-37,A:331-505 |
| P31224 | n/a | 1K8 | 7oum | e7oumB3 | B:182-273 |
| P31224 | n/a | 1K8 | 7oum | e7oumC2 | C:660-709,C:798-844 |
| P31224 | n/a | 1K8 | 7oum | e7oumC8 | C:710-797 |