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Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
4-benzyl-3-[(2-chlorobenzyl)sulfanyl]-5-thiophen-2-yl-4H-1,2,4-triazole
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FMDVHVQWAJPVKM-UHFFFAOYSA-N
SMILES
c1ccc(cc1)Cn2c(nnc2SCc3ccccc3Cl)c4cccs4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 2RKI
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Color Legend
Unassigned regionsLigand / hetero atomse2rkiA10e2rkiA11e2rkiA12e2rkiA9e2rkiB1e2rkiB2e2rkiB3
ECOD domains from experimental PDB structures interacting with ligand TT1
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P04585n/aTT12rkie2rkiA12A:1-239
P04585n/aTT12rkie2rkiA9A:317-428
P04585n/aTT12rkie2rkiB2B:6-241