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Ligand · UWH

UWH · 4-[4-(2-methoxyethyl)piperazin-1-yl]sulfonylbenzaldehyde

UWH, 4-[4-(2-methoxyethyl)piperazin-1-yl]sulfonylbenzaldehyde (C14 H20 N2 O4 S, 312.4 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 binds…

Component
UWH
Formula
C14 H20 N2 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

UWH in 2 structures; the first of them:

  • 7NZ6 · 14-3-3 sigma with RelA/p65 binding site pS45 and covalently bound TCF521-125 · UWH A301 · binds CSO38, GLU39, ASN42, LYS122, PRO167, ILE168, GLY171, ILE219 and 2 more
  • 7NZ6 · 14-3-3 sigma with RELA/P65 binding site PS45 and covalently bound TCF521-125 · UWH A301 · binds CSO38, ASN42, LYS122, PRO167, ILE168, GLY171, ILE219, ILE46 and 1 more

Residues it binds most

ILE 2, ASN 2, CSO 2, GLY 2, LYS 2, PRO 2, SER 2, GLU 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • CL · Chloride ion
  • GOL · Glycerol

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