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TargetGlutathione reductase, mitochondrial
LigandBDBM50091149
Substrate/Competitorn/a
Meas. Tech.ChEMBL_72595 (CHEMBL681183)
Ki 2200000±n/a nM
Citation Khan, MOAustin, SEChan, CYin, HMarks, DVaghjiani, SNKendrick, HYardley, VCroft, SLDouglas, KT Use of an additional hydrophobic binding site, the Z site, in the rational drug design of a new class of stronger trypanothione reductase inhibitor, quaternary alkylammonium phenothiazines. J Med Chem43:3148-56 (2000) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Glutathione reductase, mitochondrial
Name:Glutathione reductase, mitochondrial
Synonyms:GLUR | GRD1 | GSHR_HUMAN | GSR | Glutathione reductase | Glutathione reductase (GR)
Type:Enzyme
Mol. Mass.:56271.52
Organism:Homo sapiens (Human)
Description:P00390
Residue:522
Sequence:
MALLPRALSAGAGPSWRRAARAFRGFLLLLPEPAALTRALSRAMACRQEPQPQGPPPAAG
AVASYDYLVIGGGSGGLASARRAAELGARAAVVESHKLGGTCVNVGCVPKKVMWNTAVHS
EFMHDHADYGFPSCEGKFNWRVIKEKRDAYVSRLNAIYQNNLTKSHIEIIRGHAAFTSDP
KPTIEVSGKKYTAPHILIATGGMPSTPHESQIPGASLGITSDGFFQLEELPGRSVIVGAG
YIAVEMAGILSALGSKTSLMIRHDKVLRSFDSMISTNCTEELENAGVEVLKFSQVKEVKK
TLSGLEVSMVTAVPGRLPVMTMIPDVDCLLWAIGRVPNTKDLSLNKLGIQTDDKGHIIVD
EFQNTNVKGIYAVGDVCGKALLTPVAIAAGRKLAHRLFEYKEDSKLDYNNIPTVVFSHPP
IGTVGLTEDEAIHKYGIENVKTYSTSFTPMYHAVTKRKTKCVMKMVCANKEEKVVGIHMQ
GLGCDEMLQGFAVAVKMGATKADFDNTVAIHPTSSEELVTLR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50091149
n/a
NameBDBM50091149
Synonyms:(4-Chloro-benzyl)-[3-(2-chloro-phenothiazin-10-yl)-propyl]-dimethyl-ammonium (OFK002) | CHEMBL105769
TypeSmall organic molecule
Emp. Form.C24H25Cl2N2S
Mol. Mass.444.439
SMILESC[N+](C)(CCCN1c2ccccc2Sc2ccc(Cl)cc12)Cc1ccc(Cl)cc1
Structure
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