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Ligand · OE3

OE3 · ~{N}-[(1-ethyl-4-methyl-2-oxidanylidene-quinolin-6-yl)methyl]benzenesulfonamide

OE3, ~{N}-[(1-ethyl-4-methyl-2-oxidanylidene-quinolin-6-yl)methyl]benzenesulfonamide (C19 H20 N2 O3 S, 356.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5…

Component
OE3
Formula
C19 H20 N2 O3 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

OE3 in 2 structures; the first of them:

  • 8AY3 · X-RAY CRYSTAL STRUCTURE OF THE CsPYL1-iSB9-HAB1 TERNARY COMPLEX · OE3 A501 · binds LYS88, PHE90, ILE91, ARG108, VAL110, VAL112, LEU116, PRO117 and 11 more
  • 8AY8 · X-RAY CRYSTAL STRUCTURE OF THE CsPYL1(V112L, T135L,F137I, T153I, V168A)-iSB9-HAB1 TERNARY… · OE3 A302 · binds LYS88, HIS89, PHE90, ILE91, ARG108, VAL110, LEU112, PRO117 and 10 more

Residues it binds most

PHE 2, VAL 2, ILE 2, LEU 2, HIS 2, ALA 2, ARG 2, ASN 2, GLU 2, LYS 2 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion
  • CL · Chloride ion
  • GOL · Glycerol
  • VAL · Valine

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