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Literature summary for 4.2.2.1 extracted from

  • Botzki, A.; Salmen, S.; Bernhardt, G.; Buschauer, A.; Dove, S.
    Structure-based design of bacterial hyaluronan lyase inhibitors (2005), QSAR Comb. Sci., 24, 458-469.
No PubMed abstract available
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Application

Application Comment Organism
pharmacology the enzyme is a target for structure-based design of selective inhibitors as drugs in bacterial infection therapy Streptococcus agalactiae

Inhibitors

Inhibitors Comment Organism Structure
(2E)-1-furan-2-yl-3-(4-nitrophenyl)prop-2-en-1-one IC50 at enzyme optimum pH 5.0 is 0.31 mM, and 0.16 mM at physiological pH 7.4 Streptococcus agalactiae
1,3-diacetyl-benzimidazole-2-thione IC50 at enzyme optimum pH 5.0 is 0.16 mM, and 0.005 mM at physiological pH 7.4 Streptococcus agalactiae
2,2'-benzene-1,4-diyldiacetic acid IC50 at enzyme optimum pH 5.0 is 0.37 mM, and 0.90 mM at physiological pH 7.4 Streptococcus agalactiae
additional information structure-based design of bacterial hyaluronan lyase inhibitors, combinatorial chemistry database and crystal structure, method, overview Streptococcus agalactiae

Organism

Organism UniProt Comment Textmining
Streptococcus agalactiae Q53591 strain 4755
-

Synonyms

Synonyms Comment Organism
hylB4755
-
 Streptococcus agalactiae

pH Optimum

pH Optimum Minimum pH Optimum Maximum Comment Organism
5
-
-
 Streptococcus agalactiae

IC50 Value

IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
0.005 0.16 IC50 at enzyme optimum pH 5.0 is 0.16 mM, and 0.005 mM at physiological pH 7.4 Streptococcus agalactiae 1,3-diacetyl-benzimidazole-2-thione
0.16 0.31 IC50 at enzyme optimum pH 5.0 is 0.31 mM, and 0.16 mM at physiological pH 7.4 Streptococcus agalactiae (2E)-1-furan-2-yl-3-(4-nitrophenyl)prop-2-en-1-one
0.9 0.37 IC50 at enzyme optimum pH 5.0 is 0.37 mM, and 0.90 mM at physiological pH 7.4 Streptococcus agalactiae 2,2'-benzene-1,4-diyldiacetic acid