dbACP: A Comprehensive Database of Anti-Cancer Peptides

dbacp04444

General Description

Peptide name : Maculatin 1.3

Source/Organism : Fringed Tree Frog, Australia

Linear/Cyclic : Linear

Chirality : L

Sequence Information

Sequence : GLLGLLGSVVSHVVPAIVGHF

Peptide length: 21

C-terminal modification: Linear

N-terminal modification : Amidation

Non-natural peptide information: None

Activity Information

Assay type : Not specified

Assay time : Not found

Activity : IC50 : 10−5 to 10−6 M

Cell line : Not specified

Cancer type : Leukaemia

Other activity : Not found

Physicochemical Properties

Amino acid composition bar chart :

Molecular mass : 2071.4636 Dalton

Aliphatic index : 1.666

Instability index : 14.8429

Hydrophobicity (GRAVY) : 1.6238

Isoelectric point : 6.9177

Charge (pH 7) : -0.0656

Aromaticity : 0.047

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

Hydrophobic/hydrophilic ratio : 4.25

hydrophobic moment : -1.194

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

Most occurring amino acid : V

Most occurring amino acid frequency : 5

Least occurring amino acid : P

Least occurring amino acid frequency : 1

Structural Information

3D structure :

Secondary structure fraction (Helix, Turn, Sheet): (0.2, 0.3, 0.5)

SMILES Notation: CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C

Secondary Structure :

Method Prediction
GOR TEEEEEEEEEEEEEEEEEEEE
Chou-Fasman (CF) CCCEEEEEEEEEEEEEEECCC
Neural Network (NN) CCEEECCCEEECCCEEEEECC
Joint/Consensus CCEEEEEEEEEEEEEEEEECC

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 : Not available

CancerPPD : Not available

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.