Target
Leucine--tRNA ligase
Ligand
BDBM50286768
Substrate
n/a
Meas. Tech.
ChEMBL_1729553 (CHEMBL4144831)
IC50
1000±n/a nM
Citation
 Charlton, MHAleksis, RSaint-Leger, AGupta, ALoza, ERibas de Pouplana, LKaula, IGustina, DMadre, MLola, DJaudzems, KEdmund, GRandall, CPKime, LO'Neill, AJGoessens, WJirgensons, AFinn, PW -Leucinyl Benzenesulfonamides as Structurally Simplified Leucyl-tRNA Synthetase Inhibitors. ACS Med Chem Lett 9:84-88 (2018) [PubMed]  Article 
Target
Name:
Leucine--tRNA ligase
Synonyms:
6.1.1.4 | LeuRS | Leucine--tRNA ligase | Leucyl-tRNA synthetase | SYL_STAA8 | leuS
Type:
PROTEIN
Mol. Mass.:
91758.59
Organism:
Staphylococcus aureus (strain NCTC 8325)
Description:
ChEMBL_117840
Residue:
805
Sequence:
MLNYNHNQIEKKWQDYWDENKTFKTNDNLGQKKFYALDMFPYPSGAGLHVGHPEGYTATDIISRYKRMQGYNVLHPMGWDAFGLPAEQYALDTGNDPREFTKKNIQTFKRQIKELGFSYDWDREVNTTDPEYYKWTQWIFIQLYNKGLAYVDEVAVNWCPALGTVLSNEEVIDGVSERGGHPVYRKPMKQWVLKITEYADQLLADLDDLDWPESLKDMQRNWIGRSEGAKVSFDVDNTEGKVEVFTTRPDTIYGASFLVLSPEHALVNSITTDEYKEKVKAYQTEASKKSDLERTDLAKDKSGVFTGAYATNPLSGEKVQIWIADYVLSTYGTGAIMAVPAHDDRDYEFAKKFDLPIIEVIEGGNVEEAAYTGEGKHINSGELDGLENEAAITKAIQLLEQKGAGEKKVNYKLRDWLFSRQRYWGEPIPVIHWEDGTMTTVPEEELPLLLPETDEIKPSGTGESPLANIDSFVNVVDEKTGMKGRRETNTMPQWAGSCWYYLRYIDPKNENMLADPEKLKHWLPVDLYIGGVEHAVLHLLYARFWHKVLYDLAIVPTKEPFQKLFNQGMILGEGNEKMSKSKGNVINPDDIVQSHGADTLRLYEMFMGPLDAAIAWSEKGLDGSRRFLDRVWRLMVNEDGTLSSKIVTTNNKSLDKVYNQTVKKVTEDFETLGFNTAISQLMVFINECYKVDEVYKPYIEGFVKMLAPIAPHIGEELWSKLGHEESITYQPWPTYDEALLVDDEVEIVVQVNGKLRAKIKIAKDTSKEEMQEIALSNDNVKASIEGKDIMKVIAVPQKLVNIVAK
  
Inhibitor
Name:
BDBM50286768
Synonyms:
CHEMBL4171458
Type:
Small organic molecule
Emp. Form.:
C16H20N2O3S
Mol. Mass.:
320.407
SMILES:
CC(C)C[C@H](N)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
Structure:
Search PDB for entries with ligand similarity: