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Ligand · 26G

26G · 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]phenyl}ethanol

26G, 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]phenyl}ethanol (C14 H17 N3 O, 243.3 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
26G
Formula
C14 H17 N3 O
Class
ligand
Structures
3
PDB entries
2

Binding sites

26G in 3 structures; the first of them:

  • 4MES · Crystal structure of ThiT complexed with LMG116 · 26G A203 · binds TRP34, ILE36, GLU38, GLU84, TYR85, TYR122, HIS125, ALA128 and 6 more
  • 8A4D · 1-deoxy-D-xylulose 5-phosphate synthase from Pseudomonas aeruginosa with a thiamine… · 26G A701 · binds VAL113, HIS115, GLY156, HIS157, SER158, HIS301, ALA345, MET346 and 5 more
  • 4MES · Crystal structure of thit complexed with LMG116 · 26G A203 · binds TRP34, ILE36, GLU38, GLU84, TYR85, TYR122, HIS125, ALA128 and 6 more

Residues it binds most

HIS 10, GLU 10, TYR 4, ALA 10, GLY 10, ILE 10, SER 10, VAL 10, TRP 4, ARG 6 (residue and the binding sites it lines).

Found with

  • BNG · nonyl beta-D-glucopyranoside
  • 1PE · Pentaethylene glycol
  • P6G · Hexaethylene glycol
  • PEG · Di(hydroxyethyl)ether
  • PG0 · 2-(2-methoxyethoxy)ethanol
  • PG4 · Tetraethylene glycol
  • CA · Calcium ion
  • MG · Magnesium ion
  • NA · Sodium ion
  • GOL · Glycerol

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