Attributes
UniProt ID
Protein Name
Envelope glycoprotein gp160
Ligand Name
3,3,3-trifluoropropyl (2R,3S)-2-(carbamimidamidomethyl)-3-[2-(4-chloro-3-fluoroanilino)(oxo)acetamido]-6-[(methylamino)methyl]-2,3-dihydro-1H-indole-1-carboxylate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PUALTKTUZNGQRL-MOPGFXCFSA-N
SMILES
CNCc1ccc2c(c1)N(C(C2NC(=O)C(=O)Nc3ccc(c(c3)F)Cl)CNC(=N)N)C(=O)OCCC(F)(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 8FM5
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Color Legend
Unassigned regionsLigand / hetero atomse8fm5A1e8fm5A2e8fm5B1e8fm5B2e8fm5C1e8fm5C2e8fm5D1e8fm5D2
ECOD domains from experimental PDB structures interacting with ligand Y2E
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| C6G099 | n/a | Y2E | 8fm5 | e8fm5A1 | A:256-422,A:444-473 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5A2 | A:49-255,A:474-490 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5B1 | B:49-255,B:474-490 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5B2 | B:256-422,B:444-473 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5C1 | C:49-255,C:474-490 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5C2 | C:256-422,C:444-473 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5D1 | D:256-422,D:444-473 |
| C6G099 | n/a | Y2E | 8fm5 | e8fm5D2 | D:49-255,D:474-490 |