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Substrate Report for: Ala-Pro-Ala-pNA

Ostrov, D.A., Li, D.


General
Type Peptide, Pyrrolidine, Carboxamide, p-nitroaniline, pNP, Chromogen
Chemical_Nomenclature (2S)-1-[(2S)-2-aminopropanoyl]-N-[(2S)-1-(4-nitroanilino)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
Canonical SMILES CC(C(=O)N1CCCC1C(=O)NC(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N
InChI InChI=1S/C17H23N5O5/c1-10(18)17(25)21-9-3-4-14(21)16(24)19-11(2)15(23)20-12-5-7-13(8-6-12)22(26)27/h5-8,10-11,14H,3-4,9,18H2,1-2H3,(H,19,24)(H,20,23)/t10-,11-,14-/m0/s1
InChIKey XPQYHHLEYHUXJD-MJVIPROJSA-N
Other name(s) SCHEMBL8010107 ; H-Ala-Pro-Ala-pNA
________________________________________________________________________________________________
MW|377.4
Formula|C17H23N5O5
CAS_number|
PubChem|70254279
UniChem|XPQYHHLEYHUXJD-MJVIPROJSA-N
IUPHAR|
Wikipedia|

Target
Families | Ala-Pro-Ala-pNA ligand of proteins in family: Tiancimycin-TnmK-Tripeptidase-HIP
Protein | myctu-ym24

References:
Search PubMed for references concerning: Ala-Pro-Ala-pNA
    Title: 2.1 A crystal structure of the Mycobacterium tuberculosis serine hydrolase, Hip1, in its anhydro-form (Anhydrohip1)
    Brooks CL, Ostrov DA, Schumann NC, Kakkad S, Li D, Pena K, Williams BP, Goldfarb NE
    Ref: Biochemical & Biophysical Research Communications, 630:57, 2022 : PubMed