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-Structure paper
Title | Fragment-to-Hit-to-Lead Discovery of a Novel Pyridylurea Scaffold of ATP Competitive Dual Targeting Type II Topoisomerase Inhibiting Antibacterial Agents. |
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Journal, issue, pages | J. Med. Chem., Vol. 56, Page 8712-8735, Year 2013 |
Publish date | Jul 14, 2013 (structure data deposition date) |
Authors | 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. |
External links | J. Med. Chem. / PubMed:24098982 |
Methods | X-ray diffraction |
Resolution | 1.75 - 1.95 Å |
Structure data | PDB-4lp0: PDB-4lpb: |
Chemicals | ChemComp-1YM: ChemComp-HOH: ChemComp-1YP: |
Source |
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Keywords | ISOMERASE/ISOMERASE INHIBITOR / protein-inhibitor complex / ATP binding / structure-based drug design / antimicrobial / virtual screen / ATPase domain / ISOMERASE-ISOMERASE INHIBITOR complex / ATP binding domain |