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TargetThioredoxin reductase
LigandBDBM50182130
Substrate/Competitorn/a
Meas. Tech.ChEMBL_347983 (CHEMBL869602)
IC50 10000±n/a nM
Citation Andricopulo, ADAkoachere, MBKrogh, RNickel, CMcLeish, MJKenyon, GLArscott, LDWilliams, CHDavioud-Charvet, EBecker, K Specific inhibitors of Plasmodium falciparum thioredoxin reductase as potential antimalarial agents. Bioorg Med Chem Lett16:2283-92 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Thioredoxin reductase
Name:Thioredoxin reductase
Synonyms:TRXR | TRXR_PLAF7 | Thioredoxin reductase 2
Type:PROTEIN
Mol. Mass.:68716.44
Organism:Plasmodium falciparum (isolate 3D7)
Description:ChEMBL_347983
Residue:617
Sequence:
MNNVISFIGNSSNKYFQINQLHFIRIINKNIHSKNNLINSNSSYNVFYNKYFIKNTFQNK
NKLSSIYSKLNFSIKNMCKDKNEKKNYEHVNANEKNGYLASEKNELTKNKVEEHTYDYDY
VVIGGGPGGMASAKEAAAHGARVLLFDYVKPSSQGTKWGIGGTCVNVGCVPKKLMHYAGH
MGSIFKLDSKAYGWKFDNLKHDWKKLVTTVQSHIRSLNFSYMTGLRSSKVKYINGLAKLK
DKNTVSYYLKGDLSKEETVTGKYILIATGCRPHIPDDVEGAKELSITSDDIFSLKKDPGK
TLVVGASYVALECSGFLNSLGYDVTVAVRSIVLRGFDQQCAVKVKLYMEEQGVMFKNGIL
PKKLTKMDDKILVEFSDKTSELYDTVLYAIGRKGDIDGLNLESLNMNVNKSNNKIIADHL
SCTNIPSIFAVGDVAENVPELAPVAIKAGEILARRLFKDSDEIMDYSYIPTSIYTPIEYG
ACGYSEEKAYELYGKSNVEVFLQEFNNLEISAVHRQKHIRAQKDEYDLDVSSTCLAKLVC
LKNEDNRVIGFHYVGPNAGEVTQGMALALRLKVKKKDFDNCIGIHPTDAESFMNLFVTIS
SGLSYAAKGGCGGGKCG
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50182130
n/a
NameBDBM50182130
Synonyms:4,6-dinitrobenzo[c][1,2,5]thiadiazole | CHEMBL206140
TypeSmall organic molecule
Emp. Form.C6H2N4O4S
Mol. Mass.226.169
SMILES[O-][N+](=O)c1cc([N+]([O-])=O)c2nsnc2c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: