3FSJ

Crystal structure of benzoylformate decarboxylase in complex with the inhibitor MBP

Summary for 3FSJ

Entry DOI	10.2210/pdb3fsj/pdb
Related	3D7K 3F6B
Descriptor	Benzoylformate decarboxylase, 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium, CALCIUM ION, ... (4 entities in total)
Functional Keywords	thiamin adduct, aromatic hydrocarbons catabolism, calcium, decarboxylase, lyase, magnesium, mandelate pathway, metal binding, thiamine pyrophosphate, metal-binding
Biological source	Pseudomonas putida
Total number of polymer chains	1
Total formula weight	57068.27
Authors	Brandt, G.S.,Kenyon, G.L.,McLeish, M.J.,Jordan, F.,Petsko, G.A.,Ringe, D. (deposition date: 2009-01-09, release date: 2009-01-27, Last modification date: 2023-09-06)
Primary citation	Brandt, G.S.,Kneen, M.M.,Chakraborty, S.,Baykal, A.T.,Nemeria, N.,Yep, A.,Ruby, D.I.,Petsko, G.A.,Kenyon, G.L.,McLeish, M.J.,Jordan, F.,Ringe, D. Snapshot of a reaction intermediate: analysis of benzoylformate decarboxylase in complex with a benzoylphosphonate inhibitor. Biochemistry, 48:3247-3257, 2009 Cited by PubMed: 19320438 DOI: 10.1021/bi801950k PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.37 Å)

Structure validation