Reaction Details Report a problem with these data
Target
Sortase family protein
Ligand
BDBM50287722
Substrate
n/a
Meas. Tech.
ChEMBL_321313 (CHEMBL881409)
IC50
40300±n/a nM
Citation
 Oh, KB; Mar, W; Kim, S; Kim, JY; Oh, MN; Kim, JG; Shin, D; Sim, CJ; Shin, J Bis(indole) alkaloids as sortase A inhibitors from the sponge Spongosorites sp. Bioorg Med Chem Lett 15:4927-31 (2005) [PubMed]  Article 
Target
Name:
Sortase family protein
Synonyms:
Sortase | Sortase A (SrtA)
Type:
Enzyme
Mol. Mass.:
23546.15
Organism:
Staphylococcus aureus
Description:
n/a
Residue:
206
Sequence:
MKKWTNRLMTIAGVVLILVAAYLFAKPHIDNYLHDKDKDEKIEQYDKNVKEQASKDKKQQAKPQIPKDKSKVAGYIEIPDADIKEPVYPGPATPEQLNRGVSFAEENESLDDQNISIAGHTFIDRPNYQFTNLKAAKKGSMVYFKVGNETRKYKMTSIRDVKPTDVGVLDEQKGKDKQLTLITCDDYNEKTGVWEKRKIFVATEVK
  
Inhibitor
Name:
BDBM50287722
Synonyms:
CHEMBL436760 | [4-(6-Bromo-1H-indol-3-yl)-1H-imidazol-2-yl]-(6-hydroxy-1H-indol-3-yl)-methanone | [5-(6-Bromo-1H-indol-3-yl)-1H-imidazol-2-yl]-(6-hydroxy-1H-indol-3-yl)-methanone | bromotopsentin | topsentin B2
Type:
Small organic molecule
Emp. Form.:
C20H13BrN4O2
Mol. Mass.:
421.247
SMILES:
Oc1ccc2c(c[nH]c2c1)C(=O)c1nc(c[nH]1)-c1c[nH]c2cc(Br)ccc12
Structure:
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