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Ligand · 3LI

3LI · (4R)-3-(4-[4-(2-chlorophenyl)piperazin-1-yl]-6-{[2-methyl-6-(methylcarbamoyl)phenyl]amino}-1,3,5-triazin-2-yl)-N-[2-(hydroxyamino)-2-oxoethyl]-1,3-thiazolidine-4-carboxamide

3LI, (4R)-3-(4-[4-(2-chlorophenyl)piperazin-1-yl]-6-{[2-methyl-6-(methylcarbamoyl)phenyl]amino}-1,3,5-triazin-2-yl)-N-[2-(hydroxyamino)-2-oxoethyl]-1,3-thiazolidine-4-carboxamide (C28 H33 Cl N10 O4 S, 641.1 g/mol), in the MolNFT structures…

Component
3LI
Formula
C28 H33 Cl N10 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3LI in 2 structures; the first of them:

  • 3STR · Strep Peptide Deformylase with a time dependent thiazolidine hydroxamic acid · 3LI P209 · binds SER56, GLN57, GLY69, GLY70, VAL71, GLY72, LEU73, GLN77 and 14 more
  • 3STR · Strep peptide deformylase with a time dependent thiazolidine hydroxamic acid · 3LI P209 · binds SER56, GLN57, GLY69, GLY70, VAL71, GLY72, LEU73, GLN77 and 14 more

Residues it binds most

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

Found with

  • NI · Nickel (II) ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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