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Target
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic
Ligand
BDBM50488595
Substrate
n/a
Meas. Tech.
ChEMBL_925787 (CHEMBL3072080)
IC50
61000±n/a nM
Citation
 Witschel, M; Röhl, F; Niggeweg, R; Newton, T In search of new herbicidal inhibitors of the non-mevalonate pathway. Pest Manag Sci 69:559-63 (2013) [PubMed]  Article 
Target
Name:
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic
Synonyms:
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic | 1-deoxyxylulose-5-phosphate synthase | 2.2.1.7 | CLA1 | DEF | DEF | DXP synthase | DXPS | DXS | DXS_ARATH | Protein CLOROPLASTOS ALTERADOS 1
Type:
PROTEIN
Mol. Mass.:
76841.05
Organism:
Arabidopsis thaliana
Description:
ChEMBL_105557
Residue:
717
Sequence:
MASSAFAFPSYIITKGGLSTDSCKSTSLSSSRSLVTDLPSPCLKPNNNSHSNRRAKVCASLAEKGEYYSNRPPTPLLDTINYPIHMKNLSVKELKQLSDELRSDVIFNVSKTGGHLGSSLGVVELTVALHYIFNTPQDKILWDVGHQSYPHKILTGRRGKMPTMRQTNGLSGFTKRGESEHDCFGTGHSSTTISAGLGMAVGRDLKGKNNNVVAVIGDGAMTAGQAYEAMNNAGYLDSDMIVILNDNKQVSLPTATLDGPSPPVGALSSALSRLQSNPALRELREVAKGMTKQIGGPMHQLAAKVDEYARGMISGTGSSLFEELGLYYIGPVDGHNIDDLVAILKEVKSTRTTGPVLIHVVTEKGRGYPYAERADDKYHGVVKFDPATGRQFKTTNKTQSYTTYFAEALVAEAEVDKDVVAIHAAMGGGTGLNLFQRRFPTRCFDVGIAEQHAVTFAAGLACEGLKPFCAIYSSFMQRAYDQVVHDVDLQKLPVRFAMDRAGLVGADGPTHCGAFDVTFMACLPNMIVMAPSDEADLFNMVATAVAIDDRPSCFRYPRGNGIGVALPPGNKGVPIEIGKGRILKEGERVALLGYGSAVQSCLGAAVMLEERGLNVTVADARFCKPLDRALIRSLAKSHEVLITVEEGSIGGFGSHVVQFLALDGLLDGKLKWRPMVLPDRYIDHGAPADQLAEAGLMPSHIAATALNLIGAPREALF
  
Inhibitor
Name:
BDBM50488595
Synonyms:
CHEMBL2289497
Type:
Small organic molecule
Emp. Form.:
C19H16F3NO4
Mol. Mass.:
379.3298
SMILES:
CCOc1ccc(-c2onc(c2-c2ccc(OC)cc2)C(F)(F)F)c(O)c1
Structure:
Search PDB for entries with ligand similarity: