4LP0

Crystal structure of a topoisomerase ATP inhibitor

Summary for 4LP0

Entry DOI	10.2210/pdb4lp0/pdb
Related	4LPB
Descriptor	Topoisomerase IV subunit B, 6'-[(ethylcarbamoyl)amino]-4'-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridine-5-carboxylic acid (3 entities in total)
Functional Keywords	protein-inhibitor complex, atp binding, structure-based drug design, antimicrobial, virtual screen, atpase domain, isomerase-isomerase inhibitor complex, isomerase/isomerase inhibitor
Biological source	Streptococcus pneumoniae
Total number of polymer chains	1
Total formula weight	25038.12
Authors	Basarab, G.S.,Manchester, J.I.,Bist, S.,Boriack-Sjodin, P.A.,Dangel, B.,Illingsworth, R.,Uria-Nickelsen, M.,Sherer, B.A.,Sriram, S.,Eakin, A.E. (deposition date: 2013-07-14, release date: 2013-11-13, Last modification date: 2024-02-28)
Primary citation	Basarab, G.S.,Manchester, J.I.,Bist, S.,Boriack-Sjodin, P.A.,Dangel, B.,Illingworth, R.,Sherer, B.A.,Sriram, S.,Uria-Nickelsen, M.,Eakin, A.E. Fragment-to-Hit-to-Lead Discovery of a Novel Pyridylurea Scaffold of ATP Competitive Dual Targeting Type II Topoisomerase Inhibiting Antibacterial Agents. J.Med.Chem., 56:8712-8735, 2013 Cited by PubMed: 24098982 DOI: 10.1021/jm401208b PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.95 Å)

Structure validation