Reaction Details |
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Target | Pepsin A |
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Ligand | BDBM912 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_153979 |
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IC50 | 10.0±n/a nM |
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Citation | Thaisrivongs, S; Pals, DT; Kati, WM; Turner, SR; Thomasco, LM; Watt, W Design and synthesis of potent and specific renin inhibitors containing difluorostatine, difluorostatone, and related analogues. J Med Chem29:2080-7 (1986) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Pepsin A |
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Name: | Pepsin A |
Synonyms: | PEPA_PIG | PGA | Pepsin | Pepsin A precursor |
Type: | Enzyme |
Mol. Mass.: | 41232.87 |
Organism: | Porcine |
Description: | n/a |
Residue: | 385 |
Sequence: | MKWLLLLSLVVLSECLVKVPLVRKKSLRQNLIKNGKLKDFLKTHKHNPASKYFPEAAALI
GDEPLENYLDTEYFGTIGIGTPAQDFTVIFDTGSSNLWVPSVYCSSLACSDHNQFNPDDS
STFEATSQELSITYGTGSMTGILGYDTVQVGGISDTNQIFGLSETEPGSFLYYAPFDGIL
GLAYPSISASGATPVFDNLWDQGLVSQDLFSVYLSSNDDSGSVVLLGGIDSSYYTGSLNW
VPVSVEGYWQITLDSITMDGETIACSGGCQAIVDTGTSLLTGPTSAIANIQSDIGASENS
DGEMVISCSSIDSLPDIVFTINGVQYPLSPSAYILQDDDSCTSGFEGMDVPTSSGELWIL
GDVFIRQYYTVFDRANNKVGLAPVA
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BDBM912 |
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n/a |
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Name | BDBM912 |
Synonyms: | (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid | CHEMBL296588 | Iva-Val-Val-Sta-Ala-Sta-OH | N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid | PEPSTATIN | Pepstatine | US9115083, Pepstatin |
Type | Small organic molecule |
Emp. Form. | C34H63N5O9 |
Mol. Mass. | 685.8921 |
SMILES | CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r| |
Structure |
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