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Attributes

UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
(2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AVKUERGKIZMTKX-NJBDSQKTSA-N
SMILES
CC1(C(N2C(S1)C(C2=O)NC(=O)C(c3ccccc3)N)C(=O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 2RDD
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Color Legend
Unassigned regionsLigand / hetero atomse2rddA10e2rddA11e2rddA12e2rddA13e2rddA14e2rddA15e2rddA7e2rddA9e2rddB1
ECOD domains from experimental PDB structures interacting with ligand DB00415
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P31224DB00415AIC2rdde2rddA11A:1-37,A:331-498