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Target
Mandelate racemase
Ligand
BDBM81768
Substrate
n/a
Meas. Tech.
ChEMBL_1282684 (CHEMBL3101731)
Ki
700000±n/a nM
Citation
 Harty, M; Nagar, M; Atkinson, L; Legay, CM; Derksen, DJ; Bearne, SL Inhibition of serine and proline racemases by substrate-product analogues. Bioorg Med Chem Lett 24:390-3 (2013) [PubMed]  Article 
Target
Name:
Mandelate racemase
Synonyms:
MANR_PSEPU | Mandelate racemase | Mandelate racemase (MR) | mdlA
Type:
Protein
Mol. Mass.:
38561.77
Organism:
Pseudomonas putida (g-Proteobacteria)
Description:
n/a
Residue:
359
Sequence:
MSEVLITGLRTRAVNVPLAYPVHTAVGTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNEPLAPVSLEAMLAKRFCLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKLLGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTKIGYPALDQDLAVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQHDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGACRLAMPDAMKIGGVTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVIEPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV
  
Inhibitor
Name:
BDBM81768
Synonyms:
BENZYLIC ACID | CAS_6581-06-2 | NSC_5311391 | Quinuclidinyl benzilate
Type:
Small organic molecule
Emp. Form.:
C14H12O3
Mol. Mass.:
228.2433
SMILES:
OC(=O)C(O)(c1ccccc1)c1ccccc1
Structure:
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