Attributes
UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
DODECYL-ALPHA-D-MALTOSIDE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NLEBIOOXCVAHBD-YHBSTRCHSA-N
SMILES
CCCCCCCCCCCCOC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2J8S
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Color Legend
Unassigned regionsLigand / hetero atomse2j8sA1e2j8sA2e2j8sA3e2j8sA4e2j8sA5e2j8sA6e2j8sA7e2j8sA8e2j8sB15e2j8sB16e2j8sB17e2j8sB18e2j8sB19e2j8sB20e2j8sB5e2j8sB7e2j8sC10e2j8sC11e2j8sC12e2j8sC13e2j8sC14e2j8sC15e2j8sC16e2j8sC9e2j8sD1e2j8sE1
ECOD domains from experimental PDB structures interacting with ligand DB03279
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P31224 | DB03279 | LMU | 2j8s | e2j8sA7 | A:1-37,A:331-504 |
| P31224 | DB03279 | LMU | 2j8s | e2j8sA8 | A:567-673 |
| P31224 | DB03279 | LMU | 4dx5 | e4dx5B12 | B:38-134 |
| P31224 | DB03279 | LMU | 4dx5 | e4dx5B13 | B:553-659 |
| P31224 | DB03279 | LMU | 4dx5 | e4dx5B14 | B:660-709,B:798-844 |
| P31224 | DB03279 | LMU | 4dx5 | e4dx5B15 | B:135-181,B:274-330 |
| P31224 | DB03279 | LMU | 4dx5 | e4dx5B9 | B:710-797 |
| P31224 | DB03279 | LMU | 4dx7 | e4dx7B12 | B:38-134 |
| P31224 | DB03279 | LMU | 4dx7 | e4dx7B13 | B:553-659 |
| P31224 | DB03279 | LMU | 4dx7 | e4dx7B14 | B:660-709,B:798-844 |
| P31224 | DB03279 | LMU | 4dx7 | e4dx7B15 | B:135-181,B:274-330 |
| P31224 | DB03279 | LMU | 6zo8 | e6zo8B2 | B:135-181,B:274-330 |
| P31224 | DB03279 | LMU | 6zo8 | e6zo8B3 | B:505-566,B:869-1034 |
| P31224 | DB03279 | LMU | 6zo8 | e6zo8B6 | B:567-673 |
| P31224 | DB03279 | LMU | 6zo8 | e6zo8B7 | B:674-724,B:813-868 |