Literature summary for 6.2.1.33 extracted from

Reger, A.S.; Wu, R.; Dunaway-Mariano, D.; Gulick, A.M.
Structural characterization of a 140 degrees domain movement in the two-step reaction catalyzed by 4-chlorobenzoate:CoA ligase (2008), Biochemistry, 47, 8016-8025.

Crystallization (Commentary)

Crystallization (Comment)	Organism
purified recombinant CBL bound to 4-chlorobenzoyl-AMP, hanging drop vapor diffusion at 4°C using 16-24% pentaerythritol propoxylate 426, and 0.1 M K+-HEPES, pH 6.5 or 6.75, and optimized via hanging drop vapor diffusion using 14-18% PEG 1000, 50-100 mM magnesium nitrate and 100 mM MOPS, pH 7.0, the cryoprotectant contains 24% pentaerythritol propoxylate 426, 24% ethylene glycol, and 0.1 M K+-HEPES, 1 mM ATP, and 1 mM 4-chlorobenzoate, X-ray diffraction structure determination and analysis at 2.0-2.25 A resolution, molecular replacement	Alcaligenes sp.

Crystallization (Comment)

Organism

purified recombinant CBL bound to 4-chlorobenzoyl-AMP, hanging drop vapor diffusion at 4°C using 16-24% pentaerythritol propoxylate 426, and 0.1 M K+-HEPES, pH 6.5 or 6.75, and optimized via hanging drop vapor diffusion using 14-18% PEG 1000, 50-100 mM magnesium nitrate and 100 mM MOPS, pH 7.0, the cryoprotectant contains 24% pentaerythritol propoxylate 426, 24% ethylene glycol, and 0.1 M K+-HEPES, 1 mM ATP, and 1 mM 4-chlorobenzoate, X-ray diffraction structure determination and analysis at 2.0-2.25 A resolution, molecular replacement

Alcaligenes sp.

Inhibitors

Inhibitors	Comment	Organism	Structure
4-chlorophenacyl-CoA	the product analogue traps the enzyme in the thioester-forming conformation, binding structure, overview	Alcaligenes sp.

Metals/Ions

Metals/Ions	Comment	Organism	Structure
Mg2+	-	Alcaligenes sp.

Natural Substrates/ Products (Substrates)

Natural Substrates	Organism	Comment (Nat. Sub.)	Natural Products	Comment (Nat. Pro.)	Rev.	Reac.
4-Chlorobenzoate + CoA + ATP	Alcaligenes sp.	-	4-Chlorobenzoyl-CoA + AMP + diphosphate	-	?

Organism

Organism	UniProt	Comment	Textmining
Alcaligenes sp.	Q8GN86	-	-

Reaction

Reaction	Comment	Organism	Reaction ID
4-Chlorobenzoate + CoA + ATP = 4-chlorobenzoyl-CoA + AMP + diphosphate	the enzyme alternates between two conformations during catalysis of the two half-reactions, structure-function analysis, domain alternation strategy, overview	Alcaligenes sp.	a

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
4-Chlorobenzoate + CoA + ATP	-	Alcaligenes sp.	4-Chlorobenzoyl-CoA + AMP + diphosphate	-	?

Subunits

Subunits	Comment	Organism
More	determination and analysis of the structure of CBL in the adenylate forming conformation bound to 4-chlorobenzoate and the adenylate-forming conformation bound to the adenylate intermediate, overview	Alcaligenes sp.

Synonyms

Synonyms	Comment	Organism
4-chlorobenzoate:CoA ligase	-	Alcaligenes sp.
CBL	-	Alcaligenes sp.

Temperature Optimum [°C]

Temperature Optimum [°C]	Temperature Optimum Maximum [°C]	Comment	Organism
25	-	assay at	Alcaligenes sp.

pH Optimum

pH Optimum Minimum	pH Optimum Maximum	Comment	Organism
7.5	-	assay at	Alcaligenes sp.

Cofactor

Cofactor	Comment	Organism	Structure
ATP	-	Alcaligenes sp.