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TargetCysteine protease
LigandBDBM50183777
Substrate/Competitorn/a
Meas. Tech.ChEMBL_350622 (CHEMBL869006)
Ki 1000±n/a nM
Citation Vicik, RHoerr, VGlaser, MSchultheis, MHansell, EMcKerrow, JHHolzgrabe, UCaffrey, CRPonte-Sucre, AMoll, HStich, ASchirmeister, T Aziridine-2,3-dicarboxylate inhibitors targeting the major cysteine protease of Trypanosoma brucei as lead trypanocidal agents. Bioorg Med Chem Lett16:2753-7 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cysteine protease
Name:Cysteine protease
Synonyms:Rhodesain
Type:PROTEIN
Mol. Mass.:48425.78
Organism:Trypanosoma brucei rhodesiense
Description:ChEMBL_619861
Residue:450
Sequence:
MPRTEMVRFVRLPVVLLAMAACLASVALGSLHVEESLEMRFAAFKKKYGKVYKDAKEEAF
RFRAFEENMEQAKIQAAANPYATFGVTPFSDMTREEFRARYRNGASYFAAAQKRLRKTVN
VTTGRAPAAVDWREKGAVTPVKDQGQCGSCWAFSTIGNIEGQWQVAGNPLVSLSEQMLVS
CDTIDFGCGGGLMDNAFNWIVNSNGGNVFTEASYPYVSGNGEQPQCQMNGHEIGAAITDH
VDLPQDEDAIAAYLAENGPLAIAVDATSFMDYNGGILTSCTSEQLDHGVLLVGYNDSSNP
PYWIIKNSWSNMWGEDGYIRIEKGTNQCLMNQAVSSAVVGGPTPPPPPPPPPSATFTQDF
CEGKGCTKGCSHATFPTGECVQTTGVGSVIATCGASNLTQIIYPLSRSCSGLSVPITVPL
DKCIPILIGSVEYHCSTNPPTKAARLVPHQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50183777
n/a
NameBDBM50183777
Synonyms:(2S,3S)-diethyl 1-((R)-1-((S)-2-(tert-butoxycarbonyl)-4-methylpentanoyl)piperidine-5-carbonyl)aziridine-2,3-dicarboxylate | CHEMBL207526
TypeSmall organic molecule
Emp. Form.C25H41N3O8
Mol. Mass.511.6083
SMILESCCOC(=O)[C@@H]1[C@H](N1C(=O)[C@@H]1CCCN(C1)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(=O)OCC
Structure
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