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Ligand · MSB

MSB · 1-methyloxy-4-sulfone-benzene

MSB, 1-methyloxy-4-sulfone-benzene (C7 H8 O3 S, 172.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
MSB
Formula
C7 H8 O3 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

MSB in 4 structures; the first of them:

  • 1BM6 · Solution structure of the catalytic domain of human stromelysin-1 complexed to a potent… · MSB A3 · binds ASN162, VAL163, LEU164, ALA165, LEU197, VAL198, HIS201, LEU218 and 4 more
  • 1EUB · Solution structure of the catalytic domain of human collagenase-3 (mmp-13) complexed to a… · MSB A3 · binds LEU184, LEU185, ALA186, LEU218, VAL219, HIS222, LEU239, PHE241 and 3 more
  • 1BM6 · Solution structure of the catalytic domain of human stromelysin-1 complexed to a potent… · MSB A3 · binds ASN162, VAL163, LEU164, ALA165, LEU197, VAL198, HIS201, LEU218 and 4 more
  • 1EUB · Solution structure of the catalytic domain of human collagenase-3 (mmp-13) complexed to a… · MSB A3 · binds LEU184, LEU185, ALA186, LEU218, VAL219, HIS222, LEU239, PHE241 and 3 more

Residues it binds most

LEU 4, VAL 4, ALA 4, HIS 4, PRO 4, TYR 4, ASN 2, ILE 2, MET 2, PHE 2 (residue and the binding sites it lines).

Found with

  • 3MP · 3-methylpyridine
  • HAV · Hydroxyaminovaline
  • CA · Calcium ion
  • ZN · Zinc ion

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