Untitled Document

BIOPEP-UWM: Virtual Peptide Data

ID		Name
Sequence	AVPYPQR
	AVPYPQR

Chemical Mass		Number of residues
Monoisotopic Mass			µM

Additional Information

BIOPEP-UWM Virtual database

SMILES: N[C@@]([H])(C)C(=O)N[C@@]([H])(C(C)C)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)O

InChI=1S/C38H59N11O10/c1-20(2)30(47-31(52)21(3)39)36(57)49-18-6-9-28(49)34(55)46-26(19-22-10-12-23(50)13-11-22)35(56)48-17-5-8-27(48)33(54)44-24(14-15-29(40)51)32(53)45-25(37(58)59)7-4-16-43-38(41)42/h10-13,20-21,24-28,30,50H,4-9,14-19,39H2,1-3H3,(H2,40,51)(H,44,54)(H,45,53)(H,46,55)(H,47,52)(H,58,59)(H4,41,42,43)/t21-,24-,25-,26-,27-,28-,30-/m0/s1

InChIKey=GIQZFLZPSASIEJ-YYNHRMGXSA-N

Bioactivity predicted using molecular docking

Inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) according to the AHTPDB database; the BIOPEP-UWM database of bioactive peptides (ID 3480); the EROP-Moscow database; the MBPDB database
Inhibitor of lipoxygenase according to the BIOPEP-UWM database of bioactive peptides (ID 7875)
Iron chelating peptide according to the BIOPEP-UWM database of bioactive peptides (ID 10079); the PubChem database
Antioxidative peptide according to the BIOPEP-UWM database of bioactive peptides (ID 10248)

Predicted antithrombotic peptide according to the BIOPEP-UWM Virtual database (ID 221)

screen and print virtual peptide data

list of virtual peptides

Bioactive peptides links	BIO 3480	BIO 7875	BIO 10079	BIO 10248
Virtual peptides links	Virt 221