Attributes
UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
5-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}-7-fluoronaphthalene-2-carbonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CZZSYVLCOGCXLL-UHFFFAOYSA-N
SMILES
c1ccc(c(c1)OCCN2C=CC(=O)NC2=O)Oc3cc(cc4c3ccc(c4)C#N)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 6OE3
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Color Legend
Unassigned regionsLigand / hetero atomse6oe3A1e6oe3A2e6oe3A3e6oe3A4e6oe3B1e6oe3B2e6oe3B3
ECOD domains from experimental PDB structures interacting with ligand M9A
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P03366 | n/a | M9A | 6oe3 | e6oe3A2 | A:317-428 |
| P03366 | n/a | M9A | 6oe3 | e6oe3A3 | A:3-239 |
| P03366 | n/a | M9A | 7so4 | e7so4A2 | A:-1-239 |
| P03366 | n/a | M9A | 7so4 | e7so4A3 | A:317-428 |
| P03366 | n/a | M9A | 7so4 | e7so4B2 | B:5-212,B:232-237 |
| P03366 | n/a | M9A | 7so6 | e7so6A1 | A:-1-239 |
| P03366 | n/a | M9A | 7so6 | e7so6A2 | A:317-428 |
| P03366 | n/a | M9A | 7so6 | e7so6B1 | B:5-212,B:233-241 |