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TargetPhosphotransferase
LigandBDBM43835
Substrate/Competitorn/a
Meas. Tech.Inhibition Assay
Temperature298.15±0 K
Ki 2.8e+3± 1e+2 nM
IC50 500000±0.0 nM
Citation Willson, MSanejouand, YHPerie, JHannaert, VOpperdoes, F Sequencing, modeling, and selective inhibition of Trypanosoma brucei hexokinase. Chem Biol9:839-47 (2002) [PubMed]  Article
More Info.:Get all data from this article,   Solution Info,  Assay Method
 
Phosphotransferase
Name:Phosphotransferase
Synonyms:Hexokinase
Type:Protein
Mol. Mass.:51306.14
Organism:Trypanosoma brucei
Description:Q38C42
Residue:471
Sequence:
MSRRLNNILEHISIQGNDGETVRAVKRDVAMAALTNQFTMSVESMRQIMTYLLYEMVEGL
EGRESTVRMLPSYVYKADPKRATGVFYALDLGGTNFRVLRVACKEGAVVDSSTSAFKIPK
YALEGNATDLFGFIASNVKKTMETRAPEDLNRTVPLGFTFSFPVEQTKVNRGVLIRWTKG
FSTKGVQGNDVIALLQAAFGRVSLKVNVVALCNDTVGTLISHYFKDPEVQVGVIIGTGSN
ACYFETASAVTKDPAVAARGSALTPINMESGNFDSKYRFVLPTTKFDLDIDDASLNKGQQ
ALEKMISGMYLGEIARRVIVHLSSINCLPAALQTALGNRGSFESRFAGMISADRMPGLQF
TRSTIQKVCGVDVQSIEDLRIIRDVCRLVRGRAAQLSASFCCAPLVKTQTQGRATIAIDG
SVFEKIPSFRRVLQDNINRILGPECDVRAVLAKDGSGIGAAFISAMVVNDK
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  Blast E-value cutoff:
BDBM43835
n/a
NameBDBM43835
Synonyms:Glucosamine derivative, 8 | MLS000582359 | N-cyclohexyl-5-nitro-2-(1-piperidinyl)benzamide | N-cyclohexyl-5-nitro-2-piperidin-1-yl-benzamide | N-cyclohexyl-5-nitro-2-piperidin-1-ylbenzamide | N-cyclohexyl-5-nitro-2-piperidino-benzamide | SMR000200900 | cid_2967968
TypeSmall organic molecule
Emp. Form.C18H25N3O3
Mol. Mass.331.4094
SMILES[O-][N+](=O)c1ccc(N2CCCCC2)c(c1)C(=O)NC1CCCCC1
Structure
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