Literature summary for 2.3.1.169 extracted from

Chmielowska, A.; Lodowski, P.; Jaworska, M.
Redox potentials and protonation of the A-cluster from acetyl-CoA synthase. A density functional theory study (2013), J. Phys. Chem. A, 117, 12484-12496.

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Crystallization (Commentary)

Crystallization (Comment)	Organism
density functional theory and polarized continuum model study. The optimized geometries show a large structural variability of the A-cluster depending on the oxidation state and the ligand attached to the proximal nickel atom. The calculated pKa values and redox potentials are in favor of the two-electron reduction mechanism coupled to a proton transfer	Carboxydothermus hydrogenoformans

Metals/Ions

Metals/Ions	Comment	Organism	Structure
Nickel	enzyme contains two-center zerovalent nickel complexes. The proximal nickel atom Ni easily assumes planar, tetrahedral, and intermediate type coordination	Carboxydothermus hydrogenoformans

Organism

Organism	UniProt	Comment	Textmining
Carboxydothermus hydrogenoformans	P83789	-	-

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Release 2023.1 (January 2023)