DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Protease
Ligand Name
(1S,3aR,4R,6R,7aS)-octahydro-1,6-epoxy-2-benzofuran-4-yl [(2S,3R)-4-{[2-(cyclopropylamino)-1,3-benzothiazole-6-sulfonyl](2-methylpropyl)amino}-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NIEVROCNBOLPOX-ICXDCVPKSA-N
SMILES
CC(C)CN(CC(C(Cc1cc(cc(c1)F)F)NC(=O)OC2CC3CC4C2COC4O3)O)S(=O)(=O)c5ccc6c(c5)sc(n6)NC7CC7
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7TO6
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Color Legend
Unassigned regionsLigand / hetero atomse7to6A1e7to6B1
ECOD domains from experimental PDB structures interacting with ligand G77
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q5RZ08n/aG777to6e7to6A1A:1-99
Q5RZ08n/aG777to6e7to6B1B:1-99