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Target
Malate dehydrogenase
Ligand
BDBM50044974
Substrate
n/a
Meas. Tech.
ChEMBL_1448377 (CHEMBL3376861)
IC50
1300±n/a nM
Citation
 Zinglé, C; Tritsch, D; Grosdemange-Billiard, C; Rohmer, M Catechol-rhodanine derivatives: Specific and promiscuous inhibitors of Escherichia coli deoxyxylulose phosphate reductoisomerase (DXR). Bioorg Med Chem 22:3713-9 (2014) [PubMed]  Article 
Target
Name:
Malate dehydrogenase
Synonyms:
MDH_THETH | mdh
Type:
PROTEIN
Mol. Mass.:
35423.44
Organism:
Thermus thermophilus
Description:
ChEMBL_1448377
Residue:
327
Sequence:
MKAPVRVAVTGAAGQIGYSLLFRIAAGEMLGKDQPVILQLLEIPQAMKALEGVVMELEDCAFPLLAGLEATDDPKVAFKDADYALLVGAAPRKAGMERRDLLQVNGKIFTEQGRALAEVAKKDVKVLVVGNPANTNALIAYKNAPGLNPRNFTAMTRLDHNRAKAQLAKKTGTGVDRIRRMTVWGNHSSTMFPDLFHAEVDGRPALELVDMEWYEKVFIPTVAQRGAAIIQARGASSAASAANAAIEHIRDWALGTPEGDWVSMAVPSQGEYGIPEGIVYSFPVTAKDGAYRVVEGLEINEFARKRMEITAQELLDEMEQVKALGLI
  
Inhibitor
Name:
BDBM50044974
Synonyms:
CHEMBL3309762
Type:
Small organic molecule
Emp. Form.:
C24H17ClN2O5S2
Mol. Mass.:
512.985
SMILES:
Oc1ccc(\C=C2/SC(=S)N(CC(=O)Nc3ccc(Oc4ccc(Cl)cc4)cc3)C2=O)c(O)c1
Structure:
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