DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
(4S)-6-chloro-1,1-dioxo-N-(5,6,7,8-tetrahydroisoquinolin-4-yl)-1,2,3,4-tetrahydro-1lambda~6~,2-benzothiazine-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
HAFJUHKWFUKUJR-OAHLLOKOSA-N
SMILES
c1cc2c(cc1Cl)C(CNS2(=O)=O)C(=O)Nc3cncc4c3CCCC4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7GNA
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse7gnaA1e7gnaA2e7gnaB1e7gnaB2
ECOD domains from experimental PDB structures interacting with ligand RVR
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0DTD1n/aRVR7gnae7gnaA1A:187-305
P0DTD1n/aRVR7gnae7gnaA2A:1-186
P0DTD1n/aRVR7gnae7gnaB1B:1-186
P0DTD1n/aRVR7gnde7gndA1A:1-186
P0DTD1n/aRVR7gnde7gndA2A:187-305
P0DTD1n/aRVR7gnde7gndB1B:1-186
P0DTD1n/aRVR7gnde7gndB2B:187-305