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Target
1-deoxy-D-xylulose-5-phosphate synthase, chloroplastic
Ligand
BDBM50488588
Substrate
n/a
Meas. Tech.
ChEMBL_925787 (CHEMBL3072080)
IC50
33000±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:
BDBM50488588
Synonyms:
CHEMBL2289498
Type:
Small organic molecule
Emp. Form.:
C19H13N3O3S
Mol. Mass.:
363.39
SMILES:
OC(=O)c1ccc(cc1)-c1ccc(\C=N\Nc2nc3ccccc3s2)o1
Structure:
Search PDB for entries with ligand similarity: