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Ligand · O23

O23 · N-cyclopropyl-4-{8-[(thiophen-2-ylmethyl) amino]imidazo[1,2-a]pyrazin-3-yl}benzamide

O23, N-cyclopropyl-4-{8-[(thiophen-2-ylmethyl) amino]imidazo[1,2-a]pyrazin-3-yl}benzamide (C21 H19 N5 O S, 389.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
O23
Formula
C21 H19 N5 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

O23 in 2 structures; the first of them:

  • 6TNC · X-ray structure of MPS1 in complex with compound 46 · O23 A901 · binds LYS529, ILE531, VAL539, GLN541, ALA551, LYS553, GLU571, LEU575 and 14 more
  • 6TNC · X-ray structure of MPS1 in complex with compound 46 · O23 A901 · binds LYS529, ILE531, GLN541, ALA551, LYS553, GLU571, MET600, MET602 and 9 more

Residues it binds most

ILE 2, MET 2, GLU 2, LYS 2, ASP 2, LEU 2, ALA 2, ASN 2, CYS 2, GLN 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion

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