DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
(2S)-3-{[(R)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl hexadecanoate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YVYMBNSKXOXSKW-FQEVSTJZSA-N
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 6ZO5
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse6zo5A1e6zo5A2e6zo5A3e6zo5A4e6zo5A5e6zo5A6e6zo5A7e6zo5A8e6zo5B1e6zo5B2e6zo5B3e6zo5B4e6zo5B5e6zo5B6e6zo5B7e6zo5B8e6zo5C1e6zo5C2e6zo5C3e6zo5C4e6zo5C5e6zo5C6e6zo5C7e6zo5C8e6zo5D1e6zo5E1
ECOD domains from experimental PDB structures interacting with ligand LPX
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P31224n/aLPX6zo5e6zo5B8B:1-37,B:331-504
P31224n/aLPX6zo5e6zo5C2C:505-566,C:869-1034
P31224n/aLPX6zo6e6zo6C5C:1-37,C:331-504
P31224n/aLPX6zo8e6zo8B1B:1-37,B:331-504
P31224n/aLPX6zo8e6zo8C3C:505-566,C:869-1035
P31224n/aLPX6zohe6zohC2C:1-37,C:331-504
P31224n/aLPX7ouke7oukB3B:1-37,B:331-498
P31224n/aLPX7ouke7oukC1C:505-566,C:869-1033
P31224n/aLPX7oule7oulB2B:1-37,B:331-505
P31224n/aLPX7oule7oulC2C:499-552,C:845-1033
P31224n/aLPX7oume7oumB8B:1-37,B:331-505
P31224n/aLPX7oume7oumC6C:499-552,C:845-1033