DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
1-(3-chloranyl-5-iodanyl-pyridin-2-yl)piperazine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KNESUARQWHBJBR-UHFFFAOYSA-N
SMILES
c1c(cnc(c1Cl)N2CCNCC2)I
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7OUL
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Color Legend
Unassigned regionsLigand / hetero atomse7oulA1e7oulA2e7oulA3e7oulA4e7oulA5e7oulA6e7oulA7e7oulA8e7oulB1e7oulB2e7oulB3e7oulB4e7oulB5e7oulB6e7oulB7e7oulB8e7oulC1e7oulC2e7oulC3e7oulC4e7oulC5e7oulC6e7oulC7e7oulC8e7oulD1e7oulE1
ECOD domains from experimental PDB structures interacting with ligand 1KE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P31224n/a1KE7oule7oulA5A:1-37,A:331-504
P31224n/a1KE7oule7oulA6A:505-566,A:869-1042