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TargetPapain
LigandBDBM50532920
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1924137 (CHEMBL4427093)
IC50>100000±n/a nM
Citation Neves, BJDantas, RFSenger, MRMelo-Filho, CCValente, WCde Almeida, ACRezende-Neto, JMLima, EFPaveley, RFurnham, NMuratov, EKamentsky, LCarpenter, AEBraga, RCSilva-Junior, FPAndrade, CH Discovery of New Anti-Schistosomal Hits by Integration of QSAR-Based Virtual Screening and High Content Screening. J Med Chem59:7075-88 (2016) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Papain
Name:Papain
Synonyms:Allergen=Car p 1 | PAPA1_CARPA | PPI | Papaya proteinase I
Type:Enzyme
Mol. Mass.:38923.01
Organism:Carica papaya
Description:Papain was purchased from Sigma, Germany.
Residue:345
Sequence:
MAMIPSISKLLFVAICLFVYMGLSFGDFSIVGYSQNDLTSTERLIQLFESWMLKHNKIYK
NIDEKIYRFEIFKDNLKYIDETNKKNNSYWLGLNVFADMSNDEFKEKYTGSIAGNYTTTE
LSYEEVLNDGDVNIPEYVDWRQKGAVTPVKNQGSCGSCWAFSAVVTIEGIIKIRTGNLNE
YSEQELLDCDRRSYGCNGGYPWSALQLVAQYGIHYRNTYPYEGVQRYCRSREKGPYAAKT
DGVRQVQPYNEGALLYSIANQPVSVVLEAAGKDFQLYRGGIFVGPCGNKVDHAVAAVGYG
PNYILIKNSWGTGWGENGYIRIKRGTGNSYGVCGLYTSSFYPVKN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50532920
n/a
NameBDBM50532920
Synonyms:CHEMBL4522839
TypeSmall organic molecule
Emp. Form.C14H11NO2S2
Mol. Mass.289.373
SMILESO=S(=O)(Cc1ccccc1)c1nc2ccccc2s1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: