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Ligand · TKE

TKE · 1-(4-iodophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

TKE, 1-(4-iodophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea (C15 H16 I N3 O2 S2, 461.3 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
TKE
Formula
C15 H16 I N3 O2 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

TKE in 2 structures; the first of them:

  • 7O48 · Crystal structure of carbonic anhydrase from schistosoma mansoni with… · TKE A404 · binds GLU91, ILE114, GLN115, HIS117, HIS119, GLU129, HIS142, VAL144 and 8 more
  • 7O48 · Crystal structure of carbonic anhydrase from schistosoma mansoni with… · TKE A404 · binds GLN115, HIS117, HIS119, GLU129, HIS142, VAL144, PRO154, ILE158 and 4 more

Residues it binds most

HIS 4, THR 4, ILE 4, VAL 4, GLU 4, GLN 4, LEU 4, PRO 4, TRP 4, SER 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • GOL · Glycerol

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