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Ligand · XK0

XK0 · (4S)-4-(4-methoxyphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine

XK0, (4S)-4-(4-methoxyphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine (C12 H16 N2 O S, 236.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
XK0
Formula
C12 H16 N2 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

XK0 in 2 structures; the first of them:

  • 4BEK · Crystal structure of bace-1 in complex with chemical ligand · XK0 A1447 · binds LEU91, ASP93, GLY95, SER96, TYR132, PHE169, ILE171, TRP176 and 4 more
  • 4BEK · Crystal structure of bace-1 in complex with chemical ligand · XK0 A1447 · binds LEU91, ASP93, GLY95, SER96, TYR132, PHE169, ILE171, TRP176 and 4 more

Residues it binds most

ASP 2, GLY 2, ILE 2, LEU 2, PHE 2, SER 2, THR 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • DMS · Dimethyl sulfoxide

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