dbACP: A Comprehensive Database of Anti-Cancer Peptides

dbacp01383

General Description

Peptide name : Aurein-3.3

Source/Organism : Blue-thighed treefrog

Linear/Cyclic : Linear

Chirality : L

Sequence Information

Sequence : GLFDIVKKIAGHIVSSI

Peptide length: 17

C-terminal modification: Linear

N-terminal modification : Amidation

Non-natural peptide information: None

Activity Information

Assay type : Not specified

Assay time : Not found

Activity : Not found

Cell line : Not found

Cancer type : Not found

Other activity : Anti-microbial activity; Anti-fungal activity

Physicochemical Properties

Amino acid composition bar chart :

Molecular mass : 1797.1455 Dalton

Aliphatic index : 1.547

Instability index : 37.1706

Hydrophobicity (GRAVY) : 1.0529

Isoelectric point : 8.5984

Charge (pH 7) : 0.8464

Aromaticity : 0.058

Molar extinction coefficient (cysteine, cystine): (0, 0)

Hydrophobic/hydrophilic ratio : 1.83333333

hydrophobic moment : -1.278

Missing amino acid : C,R,W,Q,T,P,M,E,Y,N

Most occurring amino acid : I

Most occurring amino acid frequency : 4

Least occurring amino acid : L

Least occurring amino acid frequency : 1

Structural Information

3D structure :

Secondary structure fraction (Helix, Turn, Sheet): (0.2, 0.2, 0.4)

SMILES Notation: CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CN)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O

Secondary Structure :

Method Prediction
GOR CHHHHHHHHHCEEEEEE
Chou-Fasman (CF) CEEEEEHHHHEEEECCC
Neural Network (NN) CCCHHHHHCCCCEEEEE
Joint/Consensus CCCHHHHHHHCEEEEEE

Molecular Descriptors and ADMET Properties

Molecular Descriptors: Click here to download

ADMET Properties: Click here to download

Cross Referencing databases

Pubmed Id : 15203252

Uniprot : Not available

PDB : 7QV6

CancerPPD : Click here

ApIAPDB : Not available

CancerPPD2 ID : Not available

Reference

1 : Apponyi MA, et al. Host-defence peptides of Australian anurans: structure, mechanism of action and evolutionary significance. Peptides. 2004; 25:1035-54. doi: 10.1016/j.peptides.2004.03.006

Literature

Paper title : Host-defence peptides of Australian anurans: structure, mechanism of action and evolutionary significance.

Doi : https://doi.org/10.1016/j.peptides.2004.03.006

Abstract : Host-defence peptides secreted from the skin glands of Australian frogs and toads, are, with a few notable exceptions, different from those produced by anurans elsewhere. This review summarizes the current knowledge of the following classes of peptide isolated and characterized from Australian anurans: neuropeptides (including smooth muscle active peptides, and peptides that inhibit the production of nitric oxide from neuronal nitric oxide synthase), antimicrobial and anticancer active peptides, antifungal peptides and antimalarial peptides. Other topics covered include sex pheromones of anurans, and the application of peptide profiling to (i). recognize particular populations of anurans of the same species and to differentiate between species, and (ii). investigate evolutionary aspects of peptide formation.