DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
(2S)-2-({[(3S,4aR,8aS)-2-(4-bromobenzoyl)decahydroisoquinolin-3-yl]methyl}amino)-3-(1H-imidazol-5-yl)propanal
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SKLHMRHVVDDIOX-UBBRYJJRSA-N
SMILES
c1cc(ccc1C(=O)N2CC3CCCCC3CC2CNC(Cc4cnc[nH]4)C=O)Br
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4TWW
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Color Legend
Unassigned regionsLigand / hetero atomse4twwA1e4twwA2e4twwB1e4twwB2
ECOD domains from experimental PDB structures interacting with ligand 3A7
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0C6X7n/a3A74twwe4twwA1A:1-186
P0C6X7n/a3A74twwe4twwA2A:187-306
P0C6X7n/a3A74twwe4twwB1B:187-306
P0C6X7n/a3A74twwe4twwB2B:1-186