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Ligand · 6DQ

6DQ · 2-pyridin-3-yl-1,3-benzothiazin-4-one

6DQ, 2-pyridin-3-yl-1,3-benzothiazin-4-one (C13 H8 N2 O S, 240.3 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 it binds most and the ligands…

Component
6DQ
Formula
C13 H8 N2 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

6DQ in 2 structures; the first of them:

  • 5B4O · Crystal structure of Macrophage Migration Inhibitory Factor in complex with BTZO-14 · 6DQ A201 · binds PRO1, MET2, LYS32, TYR36, HIS62, SER63, ILE64, MET101 and 4 more
  • 5B4O · Crystal structure of macrophage migration inhibitory factor in complex with btzo-14 · 6DQ A201 · binds PRO1, MET2, LYS32, TYR36, HIS62, SER63, ILE64, MET101 and 4 more

Residues it binds most

TYR 8, MET 6, PHE 8, ASN 6, HIS 6, ILE 6, LYS 6, PRO 6, SER 6, VAL 6 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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