Reaction Details Report a problem with these data
Target
Glutamyl endopeptidase
Ligand
BDBM50412617
Substrate
n/a
Meas. Tech.
ChEMBL_558721 (CHEMBL954123)
Ki
161700±n/a nM
Citation
 Bongo, NB; Tomohiro, T; Hatanaka, Y Synthesis and evaluation of novel photoreactive alpha-amino acid analog carrying acidic and cleavable functions. Bioorg Med Chem Lett 19:80-2 (2008) [PubMed]  Article 
Target
Name:
Glutamyl endopeptidase
Synonyms:
SSPA_STAAU | sspA
Type:
PROTEIN
Mol. Mass.:
36315.14
Organism:
Staphylococcus aureus
Description:
ChEMBL_965125
Residue:
336
Sequence:
MKGKFLKVSSLFVATLTTATLVSSPAANALSSKAMDNHPQQTQSSKQQTPKIQKGGNLKPLEQREHANVILPNNDRHQITDTTNGHYAPVTYIQVEAPTGTFIASGVVVGKDTLLTNKHVVDATHGDPHALKAFPSAINQDNYPNGGFTAEQITKYSGEGDLAIVKFSPNEQNKHIGEVVKPATMSNNAETQVNQNITVTGYPGDKPVATMWESKGKITYLKGEAMQYDLSTTGGNSGSPVFNEKNEVIGIHWGGVPNEFNGAVFINENVRNFLKQNIEDIHFANDDQPNNPDNPDNPNNPDNPNNPDEPNNPDNPNNPDNPDNGDNNNSDNPDAA
  
Inhibitor
Name:
BDBM50412617
Synonyms:
CHEMBL501766
Type:
Small organic molecule
Emp. Form.:
C33H47F3N8O10S2
Mol. Mass.:
836.899
SMILES:
CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)NC(=O)c1ccc(cc1)C1(N=N1)C(F)(F)F)C(=O)NCCOCCOCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12 |r,c:24|
Structure:
Search PDB for entries with ligand similarity: