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Ligand · 1PM

1PM · methyl (3S)-3-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-4-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]piperazine-1-carboxylate

1PM, methyl (3S)-3-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-4-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]piperazine-1-carboxylate (C23 H25 N7 O5, 479.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
1PM
Formula
C23 H25 N7 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

1PM in 2 structures; the first of them:

  • 1DD7 · Murine inducible nitric oxide synthase oxygenase domain (delta 114)… · 1PM A601 · binds ARG193, CYS194, GLN257, PRO344, ALA345, VAL346, PHE363, ASN364 and 5 more
  • 1DD7 · Murine inducible nitric oxide synthase oxygenase domain (delta 114)… · 1PM A601 · binds ARG193, CYS194, GLN257, PRO344, ALA345, VAL346, PHE363, ASN364 and 5 more

Residues it binds most

TYR 2, ALA 2, ARG 2, ASN 2, CYS 2, GLN 2, GLY 2, MET 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • SO3 · Sulfite ion

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