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Ligand · 4UI

4UI · 5-[[(2R)-7-fluoranyl-2-phenyl-2,3-dihydrothieno[3,2-b]indol-4-yl]methyl]-N-oxidanyl-thiophene-2-carboxamide

4UI, 5-[[(2R)-7-fluoranyl-2-phenyl-2,3-dihydrothieno[3,2-b]indol-4-yl]methyl]-N-oxidanyl-thiophene-2-carboxamide (C22 H17 F N2 O2 S2, 424.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
4UI
Formula
C22 H17 F N2 O2 S2
Class
ligand
Structures
1
PDB entries
1

Binding sites

4UI in 1 structure; the first of them:

  • 7P2S · Crystal structure of schistosoma mansoni HDAC8 in complex with a tricyclic… · 4UI A504 · binds LYS20, ASP100, HIS141, HIS142, GLY150, PHE151, ASP186, HIS188 and 6 more

Residues it binds most

HIS 1, ASP 1, GLY 1, PHE 1, LYS 1, PRO 1, TYR 1 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • ZN · Zinc ion

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