Receptor
PDB id Resolution Class Description Source Keywords
6NPP 1.35 Å NON-ENZYME: IMMUNE CRYSTAL STRUCTURE OF EPSTEIN-BARR VIRUS NUCLEAR ANTIGEN-1, E BOUND TO FRAGMENTS EPSTEIN-BARR VIRUS (STRAIN B95-8) EBNA1 DNA BINDING PROTEIN EPSTEIN-BARR VIRUS VIRAL PROTEIPROTEIN-INHIBITOR COMPLEX
Ref.: STRUCTURE-BASED DESIGN OF SMALL-MOLECULE INHIBITORS DNA BINDING BLOCKS EPSTEIN-BARR VIRUS LATENT INFECT TUMOR GROWTH. SCI TRANSL MED V. 11 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
KWG B:701;
 Valid;
 none;
 Ki = 0.89 uM
287.312 C19 H13 N O2 c1ccc...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6NPP 1.35 Å NON-ENZYME: IMMUNE CRYSTAL STRUCTURE OF EPSTEIN-BARR VIRUS NUCLEAR ANTIGEN-1, E BOUND TO FRAGMENTS EPSTEIN-BARR VIRUS (STRAIN B95-8) EBNA1 DNA BINDING PROTEIN EPSTEIN-BARR VIRUS VIRAL PROTEIPROTEIN-INHIBITOR COMPLEX
Ref.: STRUCTURE-BASED DESIGN OF SMALL-MOLECULE INHIBITORS DNA BINDING BLOCKS EPSTEIN-BARR VIRUS LATENT INFECT TUMOR GROWTH. SCI TRANSL MED V. 11 2019
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 225 families.
1 6NPP Ki = 0.89 uM KWG C19 H13 N O2 c1ccc(cc1)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 67 families.
1 6NPP Ki = 0.89 uM KWG C19 H13 N O2 c1ccc(cc1)....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 45 families.
1 6NPP Ki = 0.89 uM KWG C19 H13 N O2 c1ccc(cc1)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: KWG; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 KWG 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: KWG; Similar ligands found: 2
No: Ligand Similarity coefficient
1 2AN 0.8883
2 IDD 0.8686
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6NPP; Ligand: KWG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 6npp.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
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