GL1X · GenesisL1 explorer

Ligand · 370

370 · 4-[(2-{5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl}-1-benzothiophen-3-yl)oxy]piperidine

370, 4-[(2-{5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl}-1-benzothiophen-3-yl)oxy]piperidine (C21 H23 N5 O2 S, 409.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
370
Formula
C21 H23 N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

370 in 2 structures; the first of them:

  • 4CAF · Plasmodium vivax N-myristoyltransferase in complex with a benzothiophene inhibitor… · 370 A1411 · binds VAL96, GLU97, ASP98, PHE103, PHE105, TYR107, THR197, TYR211 and 13 more
  • 4CAF · Plasmodium vivax N-myristoyltransferase in complex with a benzothiophene inhibitor… · 370 A1411 · binds VAL96, GLU97, ASP98, PHE103, PHE105, TYR107, THR197, TYR211 and 13 more

Residues it binds most

LEU 6, TYR 6, PHE 6, SER 6, VAL 6, ALA 6, ASN 6, ASP 6, GLU 6, HIS 6 (residue and the binding sites it lines).

Found with

  • NHW · 2-oxopentadecyl-CoA
  • MG · Magnesium ion
  • CL · Chloride ion
  • NH4 · Ammonium ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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