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Ligand · V4B

V4B · [5-methanoyl-2-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]phenyl] 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate

V4B, [5-methanoyl-2-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]phenyl] 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate (C15 H9 F3 N2 O5, 354.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
V4B
Formula
C15 H9 F3 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

V4B in 2 structures; the first of them:

  • 7O6I · 14-3-3 sigma with RelA/p65 binding site pS45 and covalently bound TCF521-085 · V4B A302 · binds ASN42, LYS122, PRO167, ILE168, GLY171, LEU218, ILE219, ILE46 and 4 more
  • 7O6I · 14-3-3 sigma with RELA/P65 binding site PS45 and covalently bound TCF521-085 · V4B A302 · binds ASN42, LYS122, PRO167, ILE168, GLY171, LEU218, ILE219, ILE46 and 4 more

Residues it binds most

ILE 2, ARG 2, GLY 2, ASN 2, LEU 2, LYS 2, PRO 2, SER 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • CL · Chloride ion

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