GL1X · GenesisL1 explorer

Ligand · 59M

59M · 4-{4-[5-(fluoromethyl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl}-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidine

59M, 4-{4-[5-(fluoromethyl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl}-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidine (C15 H14 F4 N6 S2, 418.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
59M
Formula
C15 H14 F4 N6 S2
Class
ligand
Structures
1
PDB entries
1

Binding sites

59M in 1 structure; the first of them:

  • 5DDA · Menin in complex with MI-333 · 59M A601 · binds SER155, LEU177, SER178, GLU179, ASP180, HIS181, ALA182, PHE238 and 7 more

Residues it binds most

TYR 1, MET 1, SER 1, ALA 1, ASN 1, ASP 1, CYS 1, GLU 1, HIS 1, LEU 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • PGE · Triethylene glycol

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