GL1X · GenesisL1 explorer

Ligand · 056

056 · 3-[(2,4-dichlorophenyl)methylsulfanylmethyl]benzoic acid

056, 3-[(2,4-dichlorophenyl)methylsulfanylmethyl]benzoic acid (C15 H12 Cl2 O2 S, 327.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
056
Formula
C15 H12 Cl2 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

056 in 2 structures; the first of them:

  • 2YLP · Targeting the binding function 3 site of the androgen receptor through in silico… · 056 A1922 · binds PHE673, PRO723, GLY724, ASN727, PHE826, GLU829, LEU830, ASN833 and 2 more
  • 2YLP · Targeting the binding function 3 site of the androgen receptor through in silico… · 056 A1922 · binds PHE673, PRO723, GLY724, ASN727, PHE826, GLU829, LEU830, ASN833 and 2 more

Residues it binds most

ASN 2, GLN 2, GLU 2, ILE 2, LEU 4, MET 2, PHE 2, VAL 2, GLY 2, LYS 2 (residue and the binding sites it lines).

Found with

  • TES · Testosterone
  • SO4 · Sulfate ion

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