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Ligand · XQJ

XQJ · 1-iodo-3-methylbenzene

XQJ, 1-iodo-3-methylbenzene (C7 H7 I, 218.0 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
XQJ
Formula
C7 H7 I
Class
ligand
Structures
4
PDB entries
2

Binding sites

XQJ in 4 structures; the first of them:

  • 7L3D · T4 Lysozyme L99A - 3-iodotoluene - RT · XQJ A205 · binds LEU84, VAL87, TYR88, ALA99, MET102, VAL103, VAL111, LEU118 and 3 more
  • 7L3E · T4 Lysozyme L99A - 3-iodotoluene - cryo · XQJ A204 · binds LEU84, VAL87, TYR88, ALA99, MET102, VAL103, VAL111, LEU118 and 3 more
  • 7L3D · T4 lysozyme L99A - 3-iodotoluene - rt · XQJ A205 · binds LEU84, VAL87, TYR88, ALA99, MET102, VAL103, VAL111, LEU118 and 3 more
  • 7L3E · T4 lysozyme L99A - 3-iodotoluene - cryo · XQJ A204 · binds LEU84, VAL87, TYR88, ALA99, MET102, VAL103, VAL111, LEU118 and 3 more

Residues it binds most

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

Found with

  • CL · Chloride ion
  • BME · Beta-mercaptoethanol
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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