Attributes
UniProt ID
Protein Name
Aequorin-2
Ligand Name
(2S)-8-benzyl-2-hydroperoxy-6-(4-hydroxyphenyl)-2-{[4-(trifluoromethyl)phenyl]methyl}imidazo[1,2-a]pyrazin-3(2H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ISIFAODRJRHDGD-SANMLTNESA-N
SMILES
c1ccc(cc1)CC2=NC(=CN3C2=NC(C3=O)(Cc4ccc(cc4)C(F)(F)F)OO)c5ccc(cc5)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5ZAB
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 atomse5zabA1e5zabA2e5zabB1e5zabB2e5zabC1e5zabC2e5zabD1e5zabD2e5zabE1e5zabE2e5zabF1e5zabF2e5zabG1e5zabG2e5zabH1e5zabH2e5zabI1e5zabI2e5zabJ1e5zabJ2e5zabK1e5zabK2e5zabL1e5zabL2e5zabM1e5zabM2e5zabN1e5zabN2e5zabO1e5zabO2e5zabP1e5zabP2
ECOD domains from experimental PDB structures interacting with ligand 9A3