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Ligand · XG1

XG1 · 2-butyl-2H-pyrazolo[3,4-c]quinolin-4-amine

XG1, 2-butyl-2H-pyrazolo[3,4-c]quinolin-4-amine (C14 H16 N4, 240.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
XG1
Formula
C14 H16 N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

XG1 in 2 structures; the first of them:

  • 4QC0 · Crystal structure of human TLR8 in complex with XG-1-236 · XG1 A910 · binds VAL520, ASP543, ASP545, GLY572, VAL573, THR574, PHE346, TYR348 and 6 more
  • 4QC0 · Crystal structure of human TLR8 in complex with xg-1-236 · XG1 A910 · binds VAL520, ASP543, ASP545, GLY572, VAL573, THR574, PHE346, TYR348 and 6 more

Residues it binds most

VAL 4, ASP 4, GLY 4, PHE 4, TYR 4, ARG 4, ILE 4, THR 4 (residue and the binding sites it lines).

Found with

  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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