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Ligand · 4C2

4C2 · N-[3,4-dioxo-2-(4-{[4-(trifluoromethyl)benzyl]amino}piperidin-1-yl)cyclobut-1-en-1-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide

4C2, N-[3,4-dioxo-2-(4-{[4-(trifluoromethyl)benzyl]amino}piperidin-1-yl)cyclobut-1-en-1-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide (C22 H23 F3 N4 O5 S, 512.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
4C2
Formula
C22 H23 F3 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

4C2 in 2 structures; the first of them:

  • 4YFN · Escherichia coli RNA polymerase in complex with squaramide compound 14… · 4C2 D2004 · binds PHE1270, GLY1271, GLU1272, VAL1275, LEU1291, PHE1323, LEU1326, ILE1330 and 13 more
  • 4YFN · Escherichia COLI RNA polymerase in complex with squaramide compound 14… · 4C2 D2004 · binds PHE1270, GLY1271, GLU1272, VAL1275, LEU1291, PHE1323, LEU1326, ILE1330 and 13 more

Residues it binds most

ILE 4, LYS 4, PHE 4, LEU 4, GLY 4, VAL 4, ALA 4, GLU 4, THR 4, SER 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion

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