Attributes
UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
Nalpha-{[4-(4-aminobenzene-1-sulfonyl)-2-oxopiperazin-1-yl]acetyl}-N-(4-methoxyphenyl)-N-methyl-L-phenylalaninamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
REXBCEZWZOLFMN-SANMLTNESA-N
SMILES
CN(c1ccc(cc1)OC)C(=O)C(Cc2ccccc2)NC(=O)CN3CCN(CC3=O)S(=O)(=O)c4ccc(cc4)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 8F22
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Color Legend
Unassigned regionsLigand / hetero atomse8f22A1e8f22A2e8f22B1e8f22B2e8f22C1e8f22C2e8f22D1e8f22D2e8f22E1e8f22E2e8f22F1e8f22F2e8f22G1e8f22G2e8f22H1e8f22H2e8f22I1e8f22I2e8f22J1e8f22J2e8f22K1e8f22K2e8f22L1e8f22L2
ECOD domains from experimental PDB structures interacting with ligand XBQ
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P12497 | n/a | XBQ | 8f22 | e8f22A1 | A:1-145 |
| P12497 | n/a | XBQ | 8f22 | e8f22A2 | A:146-220 |
| P12497 | n/a | XBQ | 8f22 | e8f22B1 | B:1-147 |
| P12497 | n/a | XBQ | 8f22 | e8f22B2 | B:148-219 |
| P12497 | n/a | XBQ | 8f22 | e8f22C1 | C:1-147 |
| P12497 | n/a | XBQ | 8f22 | e8f22C2 | C:148-219 |
| P12497 | n/a | XBQ | 8f22 | e8f22D1 | D:1-147 |
| P12497 | n/a | XBQ | 8f22 | e8f22D2 | D:148-219 |
| P12497 | n/a | XBQ | 8f22 | e8f22E1 | E:1-147 |
| P12497 | n/a | XBQ | 8f22 | e8f22E2 | E:148-219 |
| P12497 | n/a | XBQ | 8f22 | e8f22F1 | F:1-147 |
| P12497 | n/a | XBQ | 8f22 | e8f22F2 | F:148-219 |