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Ligand · XJB

XJB · 3-[2-(3-{[2,4-diamino-6-(4-methoxyphenyl)pyrimidin-5-yl]oxy}propoxy)phenyl]propanoic acid

XJB, 3-[2-(3-{[2,4-diamino-6-(4-methoxyphenyl)pyrimidin-5-yl]oxy}propoxy)phenyl]propanoic acid (C23 H26 N4 O5, 438.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
XJB
Formula
C23 H26 N4 O5
Class
ligand
Structures
1
PDB entries
1

Binding sites

XJB in 1 structure; the first of them:

  • 8F80 · Crystal Structure of Dihydrofolate reductase (DHFR) from Mycobacterium ulcerans Agy99 in… · XJB A202 · binds ILE7, TRP8, ALA9, ILE22, ASP29, LEU30, PHE33, LYS34 and 10 more

Residues it binds most

ILE 1, LEU 1, PRO 1, THR 1, ALA 1, ARG 1, ASP 1, HIS 1, LYS 1, PHE 1 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • EDO · 1,2-ethanediol
  • GOL · Glycerol

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