DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Neuraminidase
Ligand Name
(3~{R},4~{R},5~{S})-4-acetamido-5-[4-(hydroxymethyl)-1,2,3-triazol-1-yl]-3-pentan-3-yloxy-cyclohexene-1-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IPVDZUUVRPUAMB-ARFHVFGLSA-N
SMILES
CCC(CC)OC1C=C(CC(C1NC(=O)C)n2cc(nn2)CO)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6HP0
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 atomse6hp0A1e6hp0B1e6hp0C1e6hp0D1
ECOD domains from experimental PDB structures interacting with ligand GJT
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
C6KP13n/aGJT6hp0e6hp0A1A:82-468
C6KP13n/aGJT6hp0e6hp0B1B:82-468
C6KP13n/aGJT6hp0e6hp0C1C:82-468
C6KP13n/aGJT6hp0e6hp0D1D:82-468