DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Genome polyprotein
Ligand Name
2-(3-chlorophenyl)-2-methylpropyl [(2S)-3-cyclohexyl-1-({(1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-1-sulfanylpropan-2-yl}amino)-1-oxopropan-2-yl]carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MEDRHFREPGGTSN-OPQSODGTSA-N
SMILES
CC(C)(COC(=O)NC(CC1CCCCC1)C(=O)NC(CC2CCNC2=O)C(O)S)c3cccc(c3)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6W5J
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Color Legend
Unassigned regionsLigand / hetero atomse6w5jA1e6w5jB1
ECOD domains from experimental PDB structures interacting with ligand TKS
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q83883n/aTKS6w5je6w5jA1A:0-173
Q83883n/aTKS6w5je6w5jB1B:1-172