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Ligand · CT4

CT4 · 1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methyl-2-nitroguanidine

CT4, 1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methyl-2-nitroguanidine (C6 H8 Cl N5 O2 S, 249.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
CT4
Formula
C6 H8 Cl N5 O2 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

CT4 in 4 structures; the first of them:

  • 2ZJV · Crystal Structure of Lymnaea stagnalis Acetylcholine Binding Protein (Ls-AChBP) Complexed… · CT4 A301 · binds TRP143, THR144, TYR185, SER186, CYS187, TYR192, TRP53, LEU102 and 6 more
  • 3WTI · Crystal Structure of Lymnaea stagnalis Acetylcholine-Binding Protein Q55R Mutant… · CT4 A301 · binds TRP143, THR144, TYR185, CYS187, CYS188, TYR192, TRP53, LEU102 and 5 more
  • 2ZJV · Crystal structure of lymnaea stagnalis acetylcholine binding protein (ls-achbp) complexed… · CT4 A301 · binds TRP143, THR144, TYR185, SER186, CYS187, TYR192, TRP53, LEU102 and 6 more
  • 3WTI · Crystal structure of lymnaea stagnalis acetylcholine-binding protein Q55R mutant… · CT4 A301 · binds TRP143, THR144, TYR185, CYS187, CYS188, TYR192, TRP53, LEU102 and 5 more

Residues it binds most

TYR 20, LEU 20, TRP 20, ARG 20, CYS 20, ALA 20, MET 20, THR 20, SER 10, LYS 6 (residue and the binding sites it lines).

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