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Ligand · MJU

MJU · (3S)-1-[2-(pyrido[2,3-b]pyrazin-7-ylsulfanyl)-9H-pyrimido[4,5-b]indol-4-yl]pyrrolidin-3-amine

MJU, (3S)-1-[2-(pyrido[2,3-b]pyrazin-7-ylsulfanyl)-9H-pyrimido[4,5-b]indol-4-yl]pyrrolidin-3-amine (C21 H18 N8 S, 414.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
MJU
Formula
C21 H18 N8 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

MJU in 2 structures; the first of them:

  • 4KTN · Dna gyrase atp binding domain of enterococcus faecalis in complex with a small molecule… · MJU A301 · binds ILE45, ASN48, SER49, GLU52, ASP75, ARG78, GLY79, ILE80 and 8 more
  • 4KTN · DNA gyrase ATP binding domain of enterococcus faecalis in complex with a small molecule… · MJU A301 · binds ILE45, ASN48, SER49, GLU52, ASP75, ARG78, GLY79, ILE80 and 8 more

Residues it binds most

GLY 2, ILE 2, SER 2, VAL 2, ARG 2, ASN 2, ASP 2, GLU 2, LYS 2, PHE 2 (residue and the binding sites it lines).

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