7MQX

P. putida mandelate racemase forms an oxobenzoxaborole adduct with 2-formylphenylboronic acid

Summary for 7MQX

• Entry DOI: 10.2210/pdb7mqx/pdb
• Descriptor: Mandelate racemase, MAGNESIUM ION, (3S)-2,1-benzoxaborole-1,3(3H)-diol, ... (5 entities in total)
• Functional Keywords: boronate, isomerase, isomerase-inhibitor complex, isomerase-isomerase inhibitor complex, isomerase/isomerase inhibitor
• Biological source: Pseudomonas putida
• Total number of polymer chains: 8
• Total formula weight: 333320.56

Authors

Grandinetti, L.,Bearne, S.L.,St.Maurice, M. (deposition date: 2021-05-06, release date: 2021-08-11, Last modification date: 2023-10-18)

• Primary citation: Douglas, C.D.,Grandinetti, L.,Easton, N.M.,Kuehm, O.P.,Hayden, J.A.,Hamilton, M.C.,St Maurice, M.,Bearne, S.L.; Slow-Onset, Potent Inhibition of Mandelate Racemase by 2-Formylphenylboronic Acid. An Unexpected Adduct Clasps the Catalytic Machinery.; Biochemistry, 2021; PubMed: 34339165; DOI: 10.1021/acs.biochem.1c00374

Experimental method

X-RAY DIFFRACTION (1.914 Å)