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Ligand · 6JA

6JA · 2-[5-ethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethyl selenocyanate

6JA, 2-[5-ethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethyl selenocyanate (C9 H11 N3 O3 Se, 288.2 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…

Component
6JA
Formula
C9 H11 N3 O3 Se
Class
ligand
Structures
2
PDB entries
1

Binding sites

6JA in 2 structures; the first of them:

  • 5L47 · X-ray structure of the 2-22' locally-closed mutant of GLIC in complex with… · 6JA B402 · binds SER230, ILE233, THR226, SER230, ILE233, THR226, SER230, ILE233 and 4 more
  • 5L47 · X-ray structure of the 2-22' locally-closed mutant of glic in complex with… · 6JA B402 · binds SER230, ILE233, THR226, SER230, ILE233, THR226, SER230, ILE233 and 3 more

Residues it binds most

SER 2, ILE 2, THR 2 (residue and the binding sites it lines).

Found with

  • D12 · Dodecane
  • NA · Sodium ion
  • CL · Chloride ion
  • ACT · Acetate ion

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