Attributes
UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
~{N}-[4-[2-[[5-cyano-8-[(2~{S},6~{S})-2,6-dimethylmorpholin-4-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]prop-2-enamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NFJHNJQFJCYWCB-OALUTQOASA-N
SMILES
CC1CN(CC(O1)C)c2c3c(c(c(n2)SCCc4ccc(cc4)NC(=O)C=C)C#N)CC(OC3)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5ENR
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Color Legend
Unassigned regionsLigand / hetero atomse5enrA1e5enrA2e5enrA3e5enrA4e5enrA5e5enrA6e5enrB1e5enrB2e5enrB3e5enrB4e5enrB5e5enrB6e5enrC1e5enrC2e5enrC3e5enrC4e5enrC5e5enrC6e5enrD1e5enrE1e5enrF1