DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Envelope glycoprotein gp160
Ligand Name
~{N}'-[(1~{R},2~{R})-2-(carbamimidamidomethyl)-6-(methylaminomethyl)-2,3-dihydro-1~{H}-inden-1-yl]-~{N}-(4-chloranyl-3-fluoranyl-phenyl)ethanediamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XFJPCFZRCFHOOP-FZKQIMNGSA-N
SMILES
CNCc1ccc2c(c1)C(C(C2)CNC(=N)N)NC(=O)C(=O)Nc3ccc(c(c3)F)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 5F4L
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Color Legend
Unassigned regionsLigand / hetero atomse5f4lA1e5f4lA2e5f4lB1e5f4lB2
ECOD domains from experimental PDB structures interacting with ligand 5VE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
C6G099n/a5VE5f4le5f4lA1A:49-255,A:474-491
C6G099n/a5VE5f4le5f4lA2A:256-422,A:444-473
C6G099n/a5VE5f4le5f4lB1B:256-422,B:444-473
C6G099n/a5VE5f4le5f4lB2B:49-255,B:474-490