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Ligand · ZG4

ZG4 · N-(1-{2-[(cyclopropanesulfonyl)amino]-1,3-thiazol-4-yl}cyclopropyl)-5-(6-ethoxypyrazin-2-yl)pyridine-2-carboxamide

ZG4, N-(1-{2-[(cyclopropanesulfonyl)amino]-1,3-thiazol-4-yl}cyclopropyl)-5-(6-ethoxypyrazin-2-yl)pyridine-2-carboxamide (C21 H22 N6 O4 S2, 486.6 g/mol), in the MolNFT structures on GenesisL1: bound in 7 records (5 PDB entries). Every…

Component
ZG4
Formula
C21 H22 N6 O4 S2
Class
ligand
Structures
7
PDB entries
5

Binding sites

ZG4 in 7 structures; the first of them:

  • 7MIH · Human CTPS2 bound to inhibitor R80 · ZG4 A601 · binds ILE14, GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217 and 15 more
  • 7MIV · Mouse CTPS2-I250T bound to inhibitor R80 · ZG4 D604 · binds GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217, ILE244 and 13 more
  • 7MIF · Human CTPS1 bound to inhibitor R80 · ZG4 C602 · binds ILE14, GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217 and 13 more
  • 7MIH · Human CTPS2 bound to inhibitor R80 · ZG4 A601 · binds ILE14, GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217 and 14 more
  • 7MIP · Mouse CTPS1 bound to inhibitor R80 · ZG4 C604 · binds ILE14, GLY15, VAL18, ILE19, ARG76, PHE77, ARG217, VAL244 and 12 more
  • 7MIU · Mouse CTPS2 bound to inhibitor R80 · ZG4 D602 · binds GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217, ILE244 and 12 more
  • 7MIV · Mouse CTPS2-I250T bound to inhibitor R80 · ZG4 D604 · binds GLY15, ILE18, ILE19, ASN73, ARG76, PHE77, ARG217, ILE244 and 13 more

Residues it binds most

ILE 28, VAL 28, ARG 28, HIS 28, PHE 28, TYR 28, ASP 28, GLU 28, GLY 28, LYS 28 (residue and the binding sites it lines).

Found with

  • UTP · Uridine 5'-triphosphate
  • MG · Magnesium ion
  • GLN · Glutamine

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