GL1X · GenesisL1 explorer

Ligand · 9YH

9YH · 2-[2-[2-hydroxy-2-oxoethyl-[(3-methoxy-2-oxidanyl-phenyl)methyl]amino]ethyl-[(2-methylsulfanylphenyl)methyl]amino]ethanoic acid

9YH, 2-[2-[2-hydroxy-2-oxoethyl-[(3-methoxy-2-oxidanyl-phenyl)methyl]amino]ethyl-[(2-methylsulfanylphenyl)methyl]amino]ethanoic acid (C22 H28 N2 O6 S, 448.5 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries).…

Component
9YH
Formula
C22 H28 N2 O6 S
Class
ligand
Structures
8
PDB entries
4

Binding sites

9YH in 8 structures; the first of them:

  • 5ON0 · Crystal structure of NikA in complex with Fe-L2… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, TRP398, TYR402 and 2 more
  • 5ON5 · Crystal structure of NikA in complex with Fe-L2 (Fe-L2… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, TRP398, TYR402 and 2 more
  • 5ON8 · Crystal structure of NikA in complex with reduced Fe-L2… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, ARG386, TRP398 and 3 more
  • 5ON9 · Crystal structure of NikA in complex with reduced Fe-L1… · 9YH A602 · binds TYR22, THR23, MET27, TRP100, ARG137, TRP398, TYR402, HIS416 and 1 more
  • 5ON0 · Crystal structure of nika in complex with fe-L2 (N-(2-hydroxy… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, TRP398, TYR402 and 2 more
  • 5ON5 · Crystal structure of nika in complex with fe-L2 (fe-L2 (N-(2-hydroxy… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, TRP398, TYR402 and 2 more
  • 5ON8 · Crystal structure of nika in complex with reduced fe-L2 (N-(2-hydroxy… · 9YH A602 · binds TYR22, THR23, MET27, ARG97, TRP100, ARG137, ARG386, TRP398 and 3 more
  • 5ON9 · Crystal structure of nika in complex with reduced fe-L1 (N-(2… · 9YH A602 · binds TYR22, THR23, MET27, TRP100, ARG137, TRP398, TYR402, HIS416 and 1 more

Residues it binds most

TYR 16, ARG 16, TRP 16, THR 16, MET 16, HIS 14 (residue and the binding sites it lines).

Found with

  • FE · Fe (III) ion
  • CL · Chloride ion
  • ACT · Acetate ion
  • GOL · Glycerol
  • SO4 · Sulfate ion
  • DTT · 2,3-dihydroxy-1,4-dithiobutane

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.