dbacp04314
General Description
Peptide name : Lunasin
Source/Organism : Soyabean
Linear/Cyclic : Not found
Chirality : D
Sequence Information
Sequence : SKWQHQQDSCRKQLQGVNLTPCEKHIMEKIQGRGDDDDDDDDD
Peptide length: 43
C-terminal modification: Not found
N-terminal modification : Paragine (N) residue
Non-natural peptide information: None
Activity Information
Assay type : MTT/MTS
Assay time : Not found
Activity : IC50 : 431.9 µM
Cell line : MCF-7
Cancer type : Not specified
Other activity : Not found
Physicochemical Properties
Amino acid composition bar chart :
Molecular mass : 5028.315 Dalton
Aliphatic index : 0.430
Instability index : 48.3814
Hydrophobicity (GRAVY) : -1.762
Isoelectric point : 4.5035
Charge (pH 7) : -6.3693
Aromaticity : 0.023
Molar extinction coefficient (cysteine, cystine): (5500, 5625)
Hydrophobic/hydrophilic ratio : 0.43333333
hydrophobic moment : 0.1417
Missing amino acid : A,F,Y
Most occurring amino acid : D
Most occurring amino acid frequency : 10
Least occurring amino acid : W
Least occurring amino acid frequency : 1
Structural Information
3D structure :
Secondary structure fraction (Helix, Turn, Sheet): (0.2, 0.4, 0.1)
SMILES Notation: CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
Secondary Structure :
| Method | Prediction |
|---|---|
| GOR | HHHHHTTHHHHHTETCCTCCHHHHHHHHHHHCCCCCCCCCCTT |
| Chou-Fasman (CF) | HHHHHHCCCHHHHEEEECCCHHHHHHHHEECCCCHHHHHHCCC |
| Neural Network (NN) | CCCCCCCCCCCCCCCCCCCCCCCCCHHHHCCCCCCCCCCCCCC |
| Joint/Consensus | HHHHHCCCCCCCCCCCCCCCHHHHHHHHHCCCCCCCCCCCCCC |
Molecular Descriptors and ADMET Properties
Molecular Descriptors: Click here to download
ADMET Properties: Click here to download
Cross Referencing databases
CancerPPD : Not available
ApIAPDB : Not available
CancerPPD2 ID : Not available
Reference
1 : Alves de Souza SM, et al. Lunasin as a Promising Plant-Derived Peptide for Cancer Therapy. Int J Mol Sci. 2022; 23:(unknown pages). doi: 10.3390/ijms23179548
Literature
Paper title : Lunasin as a Promising Plant-Derived Peptide for Cancer Therapy.
Doi : https://doi.org/10.3390/ijms23179548
Abstract : Cancer has become one of the main public health problems worldwide, demanding the development of new therapeutic agents that can help reduce mortality. Lunasin is a soybean peptide that has emerged as an attractive option because its preventive and therapeutic actions against cancer. In this review, we evaluated available research on lunasin's structure and mechanism of action, which should be useful for the development of lunasin-based therapeutic products. We described data on its primary, secondary, tertiary, and possible quaternary structure, susceptibility to post-translational modifications, and structural stability. These characteristics are important for understanding drug activity and characterizing lunasin products. We also provided an overview of research on lunasin pharmacokinetics and safety. Studies examining lunasin's mechanisms of action against cancer were reviewed, highlighting reported activities, and known molecular partners. Finally, we briefly discussed commercially available lunasin products and potential combination therapeutics.