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Target
1-deoxy-D-xylulose 5-phosphate reductoisomerase
Ligand
BDBM50352795
Substrate
n/a
Meas. Tech.
ChEMBL_767067 (CHEMBL1826116)
IC50
41000±n/a nM
Citation
 Andaloussi, M; Lindh, M; Björkelid, C; Suresh, S; Wieckowska, A; Iyer, H; Karlén, A; Larhed, M Substitution of the phosphonic acid and hydroxamic acid functionalities of the DXR inhibitor FR900098: an attempt to improve the activity against Mycobacterium tuberculosis. Bioorg Med Chem Lett 21:5403-7 (2011) [PubMed]  Article 
Target
Name:
1-deoxy-D-xylulose 5-phosphate reductoisomerase
Synonyms:
DXR_MYCTU | dxr
Type:
PROTEIN
Mol. Mass.:
42846.92
Organism:
Mycobacterium tuberculosis
Description:
ChEMBL_1474510
Residue:
413
Sequence:
MTNSTDGRADGRLRVVVLGSTGSIGTQALQVIADNPDRFEVVGLAAGGAHLDTLLRQRAQTGVTNIAVADEHAAQRVGDIPYHGSDAATRLVEQTEADVVLNALVGALGLRPTLAALKTGARLALANKESLVAGGSLVLRAARPGQIVPVDSEHSALAQCLRGGTPDEVAKLVLTASGGPFRGWSAADLEHVTPEQAGAHPTWSMGPMNTLNSASLVNKGLEVIETHLLFGIPYDRIDVVVHPQSIIHSMVTFIDGSTIAQASPPDMKLPISLALGWPRRVSGAAAACDFHTASSWEFEPLDTDVFPAVELARQAGVAGGCMTAVYNAANEEAAAAFLAGRIGFPAIVGIIADVLHAADQWAVEPATVDDVLDAQRWARERAQRAVSGMASVAIASTAKPGAAGRHASTLERS
  
Inhibitor
Name:
BDBM50352795
Synonyms:
CHEMBL1208368
Type:
Small organic molecule
Emp. Form.:
C8H11O5P
Mol. Mass.:
218.1437
SMILES:
Oc1ccc(CCP(O)(O)=O)cc1O
Structure:
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