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Ligand · J38

J38 · (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbohydroxamic acid

J38, (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbohydroxamic acid (C10 H10 N2 O3 S, 238.3 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
J38
Formula
C10 H10 N2 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

J38 in 2 structures; the first of them:

  • 4BZ8 · Crystal structure of Schistosoma mansoni HDAC8 complexed with J1038 · J38 A700 · binds ASP100, HIS141, HIS142, GLY150, PHE151, ASP186, HIS188, PHE216 and 4 more
  • 4BZ8 · Crystal structure of schistosoma mansoni HDAC8 complexed with J1038 · J38 A700 · binds ASP100, HIS141, HIS142, GLY150, PHE151, ASP186, HIS188, PHE216 and 4 more

Residues it binds most

HIS 8, ASP 8, GLY 8, PHE 8, TYR 8, TRP 4, GLN 2 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • ZN · Zinc ion

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