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Ligand · ORG

ORG · 4-(cyclohexylamino)-6-piperazin-1-yl-1,3,5-triazine-2-carbonitrile

ORG, 4-(cyclohexylamino)-6-piperazin-1-yl-1,3,5-triazine-2-carbonitrile (C14 H21 N7, 287.4 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 residues it…

Component
ORG
Formula
C14 H21 N7
Class
ligand
Structures
2
PDB entries
1

Binding sites

ORG in 2 structures; the first of them:

  • 3KW9 · X-ray structure of Cathepsin K covalently bound to a triazine ligand · ORG A216 · binds GLN19, GLY23, SER24, CYS25, TRP26, CYS63, GLY64, GLY65 and 8 more
  • 3KW9 · X-ray structure of cathepsin K covalently bound to a triazine ligand · ORG A216 · binds GLN19, GLY23, SER24, CYS25, TRP26, CYS63, GLY64, GLY65 and 8 more

Residues it binds most

GLY 2, ALA 2, CYS 2, LEU 2, ASN 2, GLN 2, HIS 2, SER 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • TFA · trifluoroacetic acid

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