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Target
Papain
Ligand
BDBM50048067
Substrate
n/a
Meas. Tech.
ChEMBL_1453723 (CHEMBL3364438)
IC50
51160±n/a nM
Citation
 Wammes, AE; Hendriks, TG; Amatdjais-Groenen, HI; Wijdeven, MA; van Hest, JC; van Delft, FL; Ritschel, T; Rutjes, FP Influence of azide incorporation on binding affinity by small papain inhibitors. Bioorg Med Chem 22:5593-603 (2014) [PubMed]  Article 
Target
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:
MAMIPSISKLLFVAICLFVYMGLSFGDFSIVGYSQNDLTSTERLIQLFESWMLKHNKIYKNIDEKIYRFEIFKDNLKYIDETNKKNNSYWLGLNVFADMSNDEFKEKYTGSIAGNYTTTELSYEEVLNDGDVNIPEYVDWRQKGAVTPVKNQGSCGSCWAFSAVVTIEGIIKIRTGNLNEYSEQELLDCDRRSYGCNGGYPWSALQLVAQYGIHYRNTYPYEGVQRYCRSREKGPYAAKTDGVRQVQPYNEGALLYSIANQPVSVVLEAAGKDFQLYRGGIFVGPCGNKVDHAVAAVGYGPNYILIKNSWGTGWGENGYIRIKRGTGNSYGVCGLYTSSFYPVKN
  
Inhibitor
Name:
BDBM50048067
Synonyms:
CHEMBL3357960
Type:
Small organic molecule
Emp. Form.:
C25H22N6O3
Mol. Mass.:
454.4806
SMILES:
Oc1ccc(C[C@H](NC(=O)c2ccc(cc2)-c2ccc(CN=[N+]=[N-])cc2)C(=O)NCC#N)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: