Attributes
UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
~{N}-[4-[2-[[5-cyano-8-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]ethanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CURFTJWFXMRQDQ-HDICACEKSA-N
SMILES
CC1CN(CC(O1)C)c2c3c(c(c(n2)SCCc4ccc(cc4)NC(=O)C)C#N)CC(OC3)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5ENQ
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Color Legend
Unassigned regionsLigand / hetero atomse5enqA1e5enqA2e5enqA3e5enqA4e5enqA5e5enqA6e5enqB1e5enqB2e5enqB3e5enqB4e5enqB5e5enqB6e5enqC1e5enqC2e5enqC3e5enqC4e5enqC5e5enqC6e5enqD1e5enqE1e5enqF1