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TargetCalpain-1 catalytic subunit
LigandBDBM50114340
Substrate/Competitorn/a
Meas. Tech.ChEMBL_788734 (CHEMBL1924665)
IC50 7.5±n/a nM
Citation Stuart, BGCoxon, JMMorton, JDAbell, ADMcDonald, DQAitken, SGJones, MABickerstaffe, R Molecular modeling: a search for a calpain inhibitor as a new treatment for cataractogenesis. J Med Chem54:7503-22 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Calpain-1 catalytic subunit
Name:Calpain-1 catalytic subunit
Synonyms:CAN1_RAT | Calpain 1 | Capn1 | Cls1
Type:PROTEIN
Mol. Mass.:82108.68
Organism:Rattus norvegicus
Description:ChEMBL_788734
Residue:713
Sequence:
MAEELITPVYCTGVSAQVQKQRDKELGLGRHENAIKYLGQDYENLRARCLQNGVLFQDDA
FPPVSHSLGFKELGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAA
IASLTLNETILHRVVPYGQSFQEGYAGIFHFQLWQFGEWVDVVVDDLLPTKDGKLVFVHS
AQGNEFWSALLEKAYAKVNGSYEALSGGCTSEAFEDFTGGVTEWYDLQKAPSDLYQIILK
ALERGSLLGCSINISDIRDLEAITFKNLVRGHAYSVTDAKQVTYQGQRVNLIRMRNPWGE
VEWKGPWSDNSYEWNKVDPYEREQLRVKMEDGEFWMSFRDFIREFTKLEICNLTPDALKS
RTLRNWNTTFYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLEEVDDADDYDSRESGCSFL
LALMQKHRRRERRFGRDMETIGFAVYQVPRELAGQPVHLKRDFFLANASRAQSEHFINLR
EVSNRIRLPPGEYIVVPSTFEPNKEGDFLLRFFSEKKAGTQELDDQIQANLPDEKVLSEE
EIDDNFKTLFSKLAGDDMEISVKELQTILNRIISKHKDLRTNGFSLESCRSMVNLMDRDG
NGKLGLVEFNILWNRIRNYLTIFRKFDLDKSGSMSAYEMRMAIEAAGFKLNKKLHELIIT
RYSEPDLAVDFDNFVCCLVRLETMFRFFKILDTDLDGVVTFDLFKWLQLTMFA
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50114340
n/a
NameBDBM50114340
Synonyms:(S)-2-(4-Fluoro-benzenesulfonylamino)-N-((S)-1-formyl-3-methyl-butyl)-3-methyl-butyramide | (S)-2-(4-fluorophenylsulfonamido)-3-methyl-N-((S)-4-methyl-1-oxopentan-2-yl)butanamide | CHEMBL288365 | N-(4-fluorophenylsulfonyl)-L-valyl-L-leucinal | SJA-6017
TypeSmall organic molecule
Emp. Form.C17H25FN2O4S
Mol. Mass.372.455
SMILESCC(C)C[C@H](NC(=O)[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(C)C)C=O |r|
Structure
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