Reaction Details Report a problem with these data
Target
LgtC
Ligand
BDBM50461211
Substrate
n/a
Meas. Tech.
ChEMBL_1770911 (CHEMBL4223023)
IC50
64000±n/a nM
Citation
 Xu, Y; Cuccui, J; Denman, C; Maharjan, T; Wren, BW; Wagner, GK Structure-activity relationships in a new class of non-substrate-like covalent inhibitors of the bacterial glycosyltransferase LgtC. Bioorg Med Chem 26:2973-2983 (2018) [PubMed]  Article 
Target
Name:
LgtC
Synonyms:
LgtC
Type:
PROTEIN
Mol. Mass.:
35743.49
Organism:
Neisseria meningitidis
Description:
ChEMBL_118164
Residue:
311
Sequence:
MDIVFAADDNYAAYLCVAAKSVEAAHPDTEIRFHVLDAGISEANRAAVAANLRGGGGNIRFIDVNPEDFAGFPLNIRHISITTYARLKLGEYIADCDKVLYLDIDVLVRDSLTPLWDTDLGDNWLGACIDLFVERQEGYKQKIGMADGEYYFNAGVLLINLKKWRRHDIFKMSCEWVEQYKDVMQYQDQDILNGLFKGGVCYANSRFNFMPTNYAFMANRFASRHTDPLYRDRTNTVMPVAVSHYCGPAKPWHRDCTAWGAERFTELAGSLTTVPEEWRGKLAVPHRMFSTKRMLQRWRRKLSARFLRKIY
  
Inhibitor
Name:
BDBM50461211
Synonyms:
CHEMBL4225850
Type:
Small organic molecule
Emp. Form.:
C17H10ClF3N2O
Mol. Mass.:
350.722
SMILES:
FC(F)(F)C1=NN(C(=O)\C1=C/c1cccc(Cl)c1)c1ccccc1 |t:4|
Structure:
Search PDB for entries with ligand similarity: