dbacp05694
General Description
Peptide name : PST13-RK
Source/Organism : Derivative of tritrpticin
Linear/Cyclic : Linear
Chirality : L
Sequence Information
Sequence : KKKFPWWWPFKKK
Peptide length: 13
C-terminal modification: Linear
N-terminal modification : Amidation
Non-natural peptide information: None
Activity Information
Assay type : MTT/MTS assay
Assay time : Not found
Activity : IC50 : 90 µg/ml
Cell line : A-549
Cancer type : Lung cancer
Other activity : Anti-microbial activity
Physicochemical Properties
Amino acid composition bar chart :
Molecular mass : 1834.2568 Dalton
Aliphatic index : 0
Instability index : 25.0846
Hydrophobicity (GRAVY) : -1.823
Isoelectric point : 10.699
Charge (pH 7) : 5.7541
Aromaticity : 0.384
Molar extinction coefficient (cysteine, cystine): (16500, 16500)
Hydrophobic/hydrophilic ratio : 1.16666666
hydrophobic moment : -0.350
Missing amino acid : T,I,M,E,D,N,G,C,R,H,Q,S,Y,L,A,V
Most occurring amino acid : K
Most occurring amino acid frequency : 6
Least occurring amino acid : F
Least occurring amino acid frequency : 2
Structural Information
3D structure :
Secondary structure fraction (Helix, Turn, Sheet): (0.4, 0.1, 0.3)
SMILES Notation: NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O
Secondary Structure :
| Method | Prediction |
|---|---|
| GOR | TTTCCHHHHHHHH |
| Chou-Fasman (CF) | CCCEEEECCCCCC |
| Neural Network (NN) | CCCCCCCCCCCCC |
| Joint/Consensus | CCCCCCCCCCCCC |
Molecular Descriptors and ADMET Properties
Molecular Descriptors: Click here to download
ADMET Properties: Click here to download
Cross Referencing databases
Reference
1 : Yang ST, et al. Effect of dimerization of a beta-turn antimicrobial peptide, PST13-RK, on antimicrobial activity and mammalian cell toxicity. Biotechnol Lett. 2009; 31:233-7. doi: 10.1007/s10529-008-9848-5
Literature
Paper title : Effect of dimerization of a beta-turn antimicrobial peptide, PST13-RK, on antimicrobial activity and mammalian cell toxicity.
Doi : https://doi.org/10.1007/s10529-008-9848-5
Abstract : PST13-RK (KKKFPWWWPFKKK-NH(2)) is an improved derivative of tritrpticin adopting a beta-turn structure. In order to investigate the effect of dimerization of PST13-RK on antimicrobial activity and mammalian cell toxicity, we designed and synthesized its Cys- and Lys-linked dimers. The dimerization of PST13-RK resulted in a 2-4 fold decreased antimicrobial activity against Gram-positive and Gram-negative bacteria. However, the dimers showed a large increase in mammalian cell toxicity against mouse NIH-3T3, human MDA-MB-361, and human A549 cells. These results suggested that PST13-RK is active as a monomer to bacterial cells but as an oligomer to mammalian cells. Since the dimeric PST13-RK is much more effective against the cancer cells than the monomer, it might be an attractive candidate for anticancer chemotherapeutic drugs.