Table 2.
Compound ID, structures & activity
Compound | Chemical structure | ΔTm (°C) | IC50 (nM) | EC50 (nM) | Resolution of structure |
---|---|---|---|---|---|
Aminoquinolones | |||||
1289 | ![]() |
12 | 13 | 30 | 3.1 Å |
1312 | ![]() |
12 | 8 | 4 | 3.1 Å |
1320 | ![]() |
8.6* | 65 | 100 | 2.7 Å |
Benzimidazoles | |||||
1325 | ![]() |
10.5 | 43 | 77 | 2.95 Å |
1331 | ![]() |
9.8 | 46 | 22 | 2.75 Å |
Low molecular weight compound | |||||
89 | ![]() |
1.8** | ND | ND | 2.6 Å |
Concentration used for ΔTm determination is 50 µM in the presence of 10 mM Met, ATP and Mg2+ instead of 100 µM used for the other inhibitors
Concentration used for ΔTm determination is 800 µM against TbMetRS in the absence of Met, ATP and Mg2+