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Target
Thymidylate synthase
Ligand
BDBM84598
Substrate
n/a
Meas. Tech.
Inhibition Assay
Ki
4.4e+3±n/a nM
Citation
 Calò, S; Tondi, D; Ferrari, S; Venturelli, A; Ghelli, S; Costi, MP Constrained dansyl derivatives reveal bacterial specificity of highly conserved thymidylate synthases. Chembiochem 9:779-90 (2008) [PubMed]  Article 
Target
Name:
Thymidylate synthase
Synonyms:
TSase | TYSY_LACCA | Thymidylate Synthase (TS) | Thymidylate synthase | thyA
Type:
Enzyme
Mol. Mass.:
36576.54
Organism:
Lactobacillus casei
Description:
n/a
Residue:
316
Sequence:
MLEQPYLDLAKKVLDEGHFKPDRTHTGTYSIFGHQMRFDLSKGFPLLTTKKVPFGLIKSELLWFLHGDTNIRFLLQHRNHIWDEWAFEKWVKSDEYHGPDMTDFGHRSQKDPEFAAVYHEEMAKFDDRVLHDDAFAAKYGDLGLVYGSQWRAWHTSKGDTIDQLGDVIEQIKTHPYSRRLIVSAWNPEDVPTMALPPCHTLYQFYVNDGKLSLQLYQRSADIFLGVPFNIASYALLTHLVAHECGLEVGEFIHTFGDAHLYVNHLDQIKEQLSRTPRPAPTLQLNPDKHDIFDFDMKDIKLLNYDPYPAIKAPVAV
  
Inhibitor
Name:
BDBM84598
Synonyms:
Dansyl derivative, 2L
Type:
Small organic molecule
Emp. Form.:
C33H31I2N3O7S2
Mol. Mass.:
899.554
SMILES:
CN(C)c1cccc2c(cccc12)S(=O)(=O)N[C@@H](Cc1cc(I)c(OS(=O)(=O)c2cccc3c(cccc23)N(C)C)c(I)c1)C(O)=O |r|
Structure:
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