DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Multidrug efflux pump subunit AcrB
Ligand Name
DODECANE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SNRUBQQJIBEYMU-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 4DX5
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Color Legend
Unassigned regionsLigand / hetero atomse4dx5A1e4dx5A2e4dx5A3e4dx5A4e4dx5A5e4dx5A6e4dx5A7e4dx5A8e4dx5B1e4dx5B10e4dx5B11e4dx5B12e4dx5B13e4dx5B14e4dx5B15e4dx5B9e4dx5C23e4dx5C24e4dx5C25e4dx5C26e4dx5C27e4dx5C28e4dx5C29e4dx5C5e4dx5D1e4dx5E2
ECOD domains from experimental PDB structures interacting with ligand D12
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P31224n/aD124dx5e4dx5A1A:505-566,A:869-1044
P31224n/aD124dx5e4dx5A3A:1-37,A:331-504
P31224n/aD124dx5e4dx5B10B:499-552,B:845-1033
P31224n/aD124dx5e4dx5B11B:1-37,B:331-498
P31224n/aD124dx5e4dx5C24C:499-552,C:845-1033
P31224n/aD124dx5e4dx5C25C:1-37,C:331-498
P31224n/aD124dx7e4dx7A10A:505-566,A:864-1042
P31224n/aD124dx7e4dx7A13A:1-37,A:331-504
P31224n/aD124dx7e4dx7B10B:499-552,B:845-1033
P31224n/aD124dx7e4dx7B11B:1-37,B:331-498
P31224n/aD124dx7e4dx7C17C:499-552,C:845-1036
P31224n/aD124dx7e4dx7C18C:1-37,C:331-498
P31224n/aD125jmne5jmnA1A:505-566,A:869-1034
P31224n/aD125jmne5jmnB8B:1-37,B:331-504
P31224n/aD125jmne5jmnC7C:1-37,C:331-504
P31224n/aD125nc5e5nc5A1A:1-37,A:331-504
P31224n/aD125nc5e5nc5A6A:505-566,A:869-1044
P31224n/aD125nc5e5nc5B4B:505-566,B:869-1033
P31224n/aD125nc5e5nc5B5B:1-37,B:331-504
P31224n/aD125nc5e5nc5C7C:1-37,C:331-504
P31224n/aD125nc5e5nc5C8C:505-566,C:869-1033
P31224n/aD126baje6bajB1B:505-566,B:869-1033
P31224n/aD126baje6bajC4C:1-37,C:331-504
P31224n/aD126baje6bajC6C:505-566,C:869-1033
P31224n/aD126csxe6csxB1B:1-37,B:331-504
P31224n/aD126q4ne6q4nB6B:1-37,B:331-504
P31224n/aD126q4oe6q4oB7B:505-566,B:869-1034
P31224n/aD126q4oe6q4oC5C:1-37,C:331-498
P31224n/aD126q4pe6q4pA6A:1-37,A:331-504
P31224n/aD126q4pe6q4pB7B:505-566,B:869-1034
P31224n/aD126q4pe6q4pC5C:1-37,C:331-504
P31224n/aD126q4pe6q4pC7C:505-566,C:869-1034
P31224n/aD126zo5e6zo5A6A:1-37,A:331-504
P31224n/aD126zo5e6zo5B6B:505-566,B:869-1034
P31224n/aD126zo5e6zo5C3C:1-37,C:331-504
P31224n/aD126zo6e6zo6A7A:505-566,A:869-1042
P31224n/aD126zo6e6zo6C4C:505-566,C:869-1034
P31224n/aD126zo6e6zo6C5C:1-37,C:331-504
P31224n/aD126zo7e6zo7A7A:505-566,A:869-1042
P31224n/aD126zo7e6zo7C1C:1-37,C:331-504
P31224n/aD126zo8e6zo8A3A:1-37,A:331-504
P31224n/aD126zo8e6zo8B3B:505-566,B:869-1034
P31224n/aD126zo8e6zo8C1C:1-37,C:331-504
P31224n/aD126zo9e6zo9A5A:505-566,A:869-1042
P31224n/aD126zo9e6zo9A6A:1-37,A:331-504
P31224n/aD126zo9e6zo9C8C:1-37,C:331-504
P31224n/aD126zoae6zoaA6A:505-566,A:869-1042
P31224n/aD126zoae6zoaC4C:1-37,C:331-504
P31224n/aD126zoce6zocA2A:505-566,A:869-1034
P31224n/aD126zoce6zocA7A:1-37,A:331-504
P31224n/aD126zoce6zocB1B:505-566,B:869-1033
P31224n/aD126zoce6zocB5B:1-37,B:331-504
P31224n/aD126zoce6zocC6C:1-37,C:331-504
P31224n/aD126zode6zodC6C:1-37,C:331-504
P31224n/aD126zoge6zogA2A:505-566,A:869-1034
P31224n/aD126zoge6zogC8C:1-37,C:331-504
P31224n/aD126zohe6zohA7A:1-37,A:331-504
P31224n/aD126zohe6zohB3B:505-566,B:869-1034
P31224n/aD126zohe6zohC2C:1-37,C:331-504
P31224n/aD127oule7oulA5A:1-37,A:331-504
P31224n/aD127rr6e7rr6C4C:1-37,C:331-504
P31224n/aD127rr7e7rr7A2A:1-37,A:331-504
P31224n/aD127rr7e7rr7B5B:1-37,B:331-504
P31224n/aD127rr7e7rr7C2C:1-37,C:331-504
P31224n/aD127rr8e7rr8A8A:1-37,A:331-504