3RUX

Crystal structure of biotin-protein ligase BirA from Mycobacterium tuberculosis in complex with an acylsulfamide bisubstrate inhibitor

Summary for 3RUX

Entry DOI	10.2210/pdb3rux/pdb
Related	2CGH 3L1A 3L2Z
Descriptor	BirA bifunctional protein, 5'-deoxy-5'-[({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}sulfamoyl)amino]adenosine (3 entities in total)
Functional Keywords	biotin-protein ligase, ligase-ligase inhibitor complex, ligase/ligase inhibitor
Biological source	Mycobacterium tuberculosis
Total number of polymer chains	2
Total formula weight	58212.12
Authors	Geders, T.W.,Finzel, B.C. (deposition date: 2011-05-05, release date: 2011-12-14, Last modification date: 2024-02-28)
Primary citation	Duckworth, B.P.,Geders, T.W.,Tiwari, D.,Boshoff, H.I.,Sibbald, P.A.,Barry, C.E.,Schnappinger, D.,Finzel, B.C.,Aldrich, C.C. Bisubstrate Adenylation Inhibitors of Biotin Protein Ligase from Mycobacterium tuberculosis. Chem.Biol., 18:1432-1441, 2011 Cited by PubMed: 22118677 DOI: 10.1016/j.chembiol.2011.08.013 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation