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Ligand · 2XQ

2XQ · 3-[[3-methyl-2-[[2,3,4-tris(fluoranyl)phenoxy]methyl]-1-benzofuran-4-yl]oxy]-N-(pyridin-3-ylmethyl)propan-1-amine

2XQ, 3-[[3-methyl-2-[[2,3,4-tris(fluoranyl)phenoxy]methyl]-1-benzofuran-4-yl]oxy]-N-(pyridin-3-ylmethyl)propan-1-amine (C25 H23 F3 N2 O3, 456.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…

Component
2XQ
Formula
C25 H23 F3 N2 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

2XQ in 4 structures; the first of them:

  • 4CAV · Crystal structure of Aspergillus fumigatus N-myristoyl transferase in complex with… · 2XQ A1494 · binds TYR147, PHE155, PHE157, TYR159, PHE214, TYR263, TYR264, HIS265 and 14 more
  • 4QBJ · Crystal structure of N-myristoyl transferase from Aspergillus fumigatus complexed with a… · 2XQ A505 · binds TYR147, PHE157, TYR159, PHE214, TYR263, TYR264, HIS265, LEU273 and 14 more
  • 4CAV · Crystal structure of aspergillus fumigatus N-myristoyl transferase in complex with… · 2XQ A1494 · binds TYR147, PHE155, PHE157, TYR159, PHE214, TYR263, TYR264, HIS265 and 14 more
  • 4QBJ · Crystal structure of N-myristoyl transferase from aspergillus fumigatus complexed with a… · 2XQ A505 · binds TYR147, PHE157, TYR159, PHE214, TYR263, TYR264, HIS265, LEU273 and 14 more

Residues it binds most

TYR 4, LEU 4, PHE 4, VAL 4, ALA 4, ASN 4, HIS 4, MET 4, SER 4 (residue and the binding sites it lines).

Found with

  • MYA · Tetradecanoyl-coa
  • NHM · S-(2-oxo)pentadecylcoa
  • CL · Chloride ion
  • SO4 · Sulfate ion

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