Reaction Details 
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Phospho-N-acetylmuramoyl-pentapeptide-transferase
Ligand
BDBM50526666
Substrate
n/a
Meas. Tech.
ChEMBL_1900477 (CHEMBL4402699)
IC50
15000±n/a nM
Citation
Patel, B; Ryan, P; Makwana, V; Zunk, M; Rudrawar, S; Grant, G Caprazamycins: Promising lead structures acting on a novel antibacterial target MraY. Eur J Med Chem 171:462-474 (2019) [PubMed] ArticleMore Info.:
Target
Name:
Phospho-N-acetylmuramoyl-pentapeptide-transferase
Synonyms:
2.7.8.13 | MRAY_AQUAE | Phospho-N-acetylmuramoyl-pentapeptide-transferase | UDP-MurNAc-pentapeptide phosphotransferase | mraY
Type:
PROTEIN
Mol. Mass.:
40354.31
Organism:
Aquifex aeolicus (strain VF5)
Description:
ChEMBL_117805
Residue:
359
Sequence:
MLYQLALLLKDYWFAFNVLKYITFRSFTAVLIAFFLTLVLSPSFINRLRKIQRLFGGYVREYTPESHEVKKYTPTMGGIVILIVVTLSTLLLMRWDIKYTWVVLLSFLSFGTIGFWDDYVKLKNKKGISIKTKFLLQVLSASLISVLIYYWADIDTILYFPFFKELYVDLGVLYLPFAVFVIVGSANAVNLTDGLDGLAIGPAMTTATALGVVAYAVGHSKIAQYLNIPYVPYAGELTVFCFALVGAGLGFLWFNSFPAQMFMGDVGSLSIGASLATVALLTKSEFIFAVAAGVFVFETISVILQIIYFRWTGGKRLFKRAPFHHHLELNGLPEPKIVVRMWIISILLAIIAISMLKLR
Inhibitor
Name:
BDBM50526666
Synonyms:
CHEMBL4592367
Type:
Small organic molecule
Emp. Form.:
C27H44N6O9
Mol. Mass.:
596.6731
SMILES:
[H][C@@]1(O[C@@H](Cc2cn(CCCCCCCCCC)nn2)[C@@]2([H])O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)O[C@H](CN)[C@@H](O)[C@H]1O |r|
Structure:
