DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
(2~{S})-4-methyl-~{N}-[(2~{S},3~{R})-3-oxidanyl-4-oxidanylidene-1-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]-4-[(phenylmethyl)amino]butan-2-yl]-2-[[(~{E})-3-phenylprop-2-enoyl]amino]pentanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VGTVWUUFUCDHSP-BXCMFHCISA-N
SMILES
CC(C)CC(C(=O)NC(CC1CCNC1=O)C(C(=O)NCc2ccccc2)O)NC(=O)C=Cc3ccccc3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6FV1
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Color Legend
Unassigned regionsLigand / hetero atomse6fv1A1e6fv1A2e6fv1B1e6fv1B2e6fv1C1e6fv1C2
ECOD domains from experimental PDB structures interacting with ligand E8E
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0C6X5n/aE8E6fv1e6fv1A1A:1-186
P0C6X5n/aE8E6fv1e6fv1A2A:187-300
P0C6X5n/aE8E6fv1e6fv1B1B:1-186
P0C6X5n/aE8E6fv1e6fv1B2B:187-299
P0C6X5n/aE8E6fv1e6fv1C1C:1-186
P0C6X5n/aE8E6fv1e6fv1C2C:187-299