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Ligand · KPC

KPC · (2-[2-ketopropylthio]ethanesulfonate

KPC, (2-[2-ketopropylthio]ethanesulfonate (C5 H10 O4 S2, 198.3 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
KPC
Formula
C5 H10 O4 S2
Class
ligand
Structures
6
PDB entries
3

Binding sites

KPC in 6 structures; the first of them:

  • 1MO9 · NADPH dependent 2-ketopropyl coenzyme M OXIDOREDUCTASE/CARBOXYLASE complexed with… · KPC A1015 · binds GLY52, ALA53, ARG56, PHE57, GLY79, CYS82, PRO83, VAL88 and 7 more
  • 2CFC · structural basis for stereo selectivity in the (R)- and (S)- hydroxypropylethane… · KPC A1252 · binds THR91, SER142, VAL143, ALA144, PHE149, ARG152, TYR155, GLY186 and 5 more
  • 3Q6J · Structural basis for carbon dioxide binding by 2-ketopropyl coenzyme M… · KPC A526 · binds GLY52, ALA53, ARG56, PHE57, GLY79, CYS82, PRO83, VAL88 and 6 more
  • 1MO9 · NADPH dependent 2-ketopropyl coenzyme M OXIDOREDUCTASE/CARBOXYLASE complexed with… · KPC A1015 · binds GLY52, ALA53, ARG56, PHE57, GLY79, CYS82, PRO83, VAL88 and 7 more
  • 2CFC · Structural basis for stereo selectivity in the (R)- and (S)-hydroxypropylethane… · KPC A1252 · binds THR91, SER142, VAL143, ALA144, PHE149, ARG152, TYR155, GLY186 and 5 more
  • 3Q6J · Structural basis for carbon dioxide binding by 2-ketopropyl coenzyme M… · KPC A526 · binds GLY52, ALA53, ARG56, PHE57, GLY79, CYS82, PRO83, VAL88 and 6 more

Residues it binds most

ARG 14, MET 14, GLY 14, PHE 14, THR 8, PRO 6, ALA 8, TYR 8, VAL 8, CYS 6 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • ACN · Acetone
  • BCT · Bicarbonate ion
  • COM · 1-thioethanesulfonic acid
  • NAD · Nicotinamide-adenine-dinucleotide
  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • MG · Magnesium ion
  • CO2 · Carbon dioxide

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