Reaction Details Report a problem with these data
Target
Tyrosine--tRNA ligase
Ligand
BDBM199139
Substrate
n/a
Meas. Tech.
In vitro Enzyme Inhibition Assay
pH
7.9±n/a
IC50
1.67e+3± 1.4e+2 nM
Comments
extracted
Citation
More Info.:
Target
Name:
Tyrosine--tRNA ligase
Synonyms:
SYY_STAAS | Tyrosyl-tRNA synthetase | tyrS
Type:
Protein
Mol. Mass.:
47586.43
Organism:
Staphylococcus aureus (strain MSSA476)
Description:
n/a
Residue:
420
Sequence:
MTNVLIEDLKWRGLIYQQTDEQGIEDLLNKEQVTLYCGADPTADSLHIGHLLPFLTLRRFQEHGHRPIVLIGGGTGMIGDPSGKSEERVLQTEEQVDKNIEGISKQMHNIFEFGTDHGAVLVNNRDWLGQISLISFLRDYGKHVGVNYMLGKDSIQSRLEHGISYTEFTYTILQAIDFGHLNRELNCKIQVGGSDQWGNITSGIELMRRMYGQTDAYGLTIPLVTKSDGKKFGKSESGAVWLDAEKTSPYEFYQFWINQSDEDVIKFLKYFTFLGKEEIDRLEQSKNEAPHLREAQKTLAEEVTKFIHGEDALNDAIRISQALFSGDLKSLSAKELKDGFKDVPQVTLSNDTTNIVEVLIETGISPSKRQAREDVNNGAIYINGERQQDVNYALAPEDKIDGEFTIIRRGKKKYFMVNYQ
Inhibitor
Name:
BDBM199139
Synonyms:
2-(2-Methyl-5-nitro-1H-imidazol-1-yl)-ethyl-1-(4-chlorophenyl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate (4k)
Type:
Small organic molecule
Emp. Form.:
C23H20ClN5O5
Mol. Mass.:
481.888
SMILES:
COc1ccc(cc1)-c1cc(nn1-c1ccc(Cl)cc1)C(=O)OCCn1c(C)ncc1[N+]([O-])=O