6QX2
3.4A structure of benzoisoxazole 3 with S.aureus DNA gyrase and DNA
Summary for 6QX2
Entry DOI | 10.2210/pdb6qx2/pdb |
Related | 6QX1 |
Descriptor | DNA gyrase subunit B,DNA gyrase subunit B, DNA (5'-D(*GP*AP*GP*CP*GP*TP*AP*CP*GP*GP*CP*CP*GP*TP*AP*CP*GP*CP*TP*T)-3'), (2~{R})-2-[[5-(2-chlorophenyl)-1,2-benzoxazol-3-yl]oxy]-2-phenyl-ethanamine, ... (13 entities in total) |
Functional Keywords | inhibitor, dna complex, isomerase |
Biological source | Staphylococcus aureus More |
Total number of polymer chains | 36 |
Total formula weight | 993375.08 |
Authors | Bax, B.D. (deposition date: 2019-03-06, release date: 2019-04-17, Last modification date: 2024-01-24) |
Primary citation | Thalji, R.K.,Raha, K.,Andreotti, D.,Checchia, A.,Cui, H.,Meneghelli, G.,Profeta, R.,Tonelli, F.,Tommasi, S.,Bakshi, T.,Donovan, B.T.,Howells, A.,Jain, S.,Nixon, C.,Quinque, G.,McCloskey, L.,Bax, B.D.,Neu, M.,Chan, P.F.,Stavenger, R.A. Structure-guided design of antibacterials that allosterically inhibit DNA gyrase. Bioorg.Med.Chem.Lett., 29:1407-1412, 2019 Cited by PubMed: 30962087DOI: 10.1016/j.bmcl.2019.03.029 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (3.4 Å) |
Structure validation
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