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Ligand · U85

U85 · 1-((4'-((6-amino-3H-purin-3-yl)methyl)biphenyl-4-yl)methyl)-4-(dimethylamino)pyridinium

U85, 1-((4'-((6-amino-3H-purin-3-yl)methyl)biphenyl-4-yl)methyl)-4-(dimethylamino)pyridinium (C26 H26 N7 +1, 436.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
U85
Formula
C26 H26 N7 +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

U85 in 2 structures; the first of them:

  • 4BR3 · Determination of potential scaffolds for human choline kinase alpha 1 by chemical… · U85 A1458 · binds ARG117, ASN305, ASP306, GLN308, TYR333, GLU349, TYR354, TRP420 and 6 more
  • 4BR3 · Determination of potential scaffolds for human choline kinase alpha 1 by chemical… · U85 A1458 · binds ARG117, ASN305, ASP306, GLN308, TYR333, GLU349, TYR354, TRP420 and 6 more

Residues it binds most

TYR 4, ARG 4, GLU 4, TRP 4, ASN 4, ASP 4, GLN 4, ILE 4, PHE 4, GLY 2 (residue and the binding sites it lines).

Found with

  • A4V · 3-benzyladenine
  • PO4 · Phosphate ion

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