Rhea:RHEA:16846

Published in: "Computational Study of the Citrate Synthase Catalyzed Deprotonation of Acetyl-Coenzyme A and Fluoroacetyl-Coenzyme A: Demonstration of a Layered Quantum Mechanical Approach." W. Yang et al. J. Phys. Chem. B, 107, 5986-5994, 2003.

oxaloacetate + acetyl-CoA + H2O => citrate + CoA + H+

= Oxaloacetate[C4H4O5] + acetyl-CoA(4-)[C23H34N7O17P3S] + H2O[H2O] + Citrate[C6H8O7] + coenzyme A(4-)[C21H32N7O16P3S] + H+[H]

DB Links

  • BioCyc: CITSYN-RXN
  • EC Number: 2.3.3.1
  • EC Number: 2.3.3.16
  • EC Number: 2.3.3.3
  • Rhea: RHEA:16846
  • Reactome: R-HSA-70975.4
  • MACiE: M0078
Alias

Metabolites

Substrates
metabolite compartment Structure
Products
metabolite compartment Structure
Oxaloacetate

Formula: C4H4O5		 Cytoplasm
acetyl-CoA(4-)

Formula: C23H34N7O17P3S		 Cytoplasm
H2O

Formula: H2O		 Cytoplasm
Citrate

Formula: C6H8O7		 Cytoplasm
coenzyme A(4-)

Formula: C21H32N7O16P3S		 Cytoplasm
H+

Formula: H		 Cytoplasm