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Ligand · E2H

E2H · 6-chloranyl-~{N}-(1-methylcyclopropyl)-1,1-bis(oxidanylidene)-4~{H}-thieno[3,2-E][1,2, 4]thiadiazin-3-amine

E2H, 6-chloranyl-~{N}-(1-methylcyclopropyl)-1,1-bis(oxidanylidene)-4~{H}-thieno[3,2-E][1,2, 4]thiadiazin-3-amine (C9 H10 Cl N3 O2 S2, 291.8 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding…

Component
E2H
Formula
C9 H10 Cl N3 O2 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

E2H in 4 structures; the first of them:

  • 7W4O · The structure of KATP H175K mutant in pre-open state · E2H B1604 · binds PRO551, ILE552, VAL555, LEU556, LEU580, PHE583, HIS584, LEU1027 and 7 more
  • 7W4P · The structure of KATP H175K mutant in closed state · E2H B1604 · binds PRO551, ILE552, VAL555, LEU580, HIS584, LEU1027, ILE1030, ASP1031 and 6 more
  • 7W4O · The structure of katp H175K mutant in pre-open state · E2H B1604 · binds PRO551, ILE552, VAL555, LEU580, HIS584, ILE1030, ASP1031, CYS1072 and 3 more
  • 7W4P · The structure of katp H175K mutant in closed state · E2H B1604 · binds ILE552, VAL555, LEU580, HIS584, LEU1027, ILE1030, ASP1031, CYS1072 and 2 more

Residues it binds most

LEU 16, ILE 16, ASP 16, CYS 16, HIS 16, MET 16, THR 16, VAL 16, PRO 12, TYR 12 (residue and the binding sites it lines).

Found with

  • ADP · Adenosine-5'-diphosphate
  • ATP · Adenosine-5'-triphosphate
  • MG · Magnesium ion

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