dbACP: A Comprehensive Database of Anti-Cancer Peptides

dbacp08327

General Description

Peptide name : Sample Peptide 1 from EP3604345B1

Source/Organism : Synthetic

Linear/Cyclic : Linear

Chirality : L

Sequence Information

Sequence : MQIPQAPWPVVWAVLQLGWRKKRTLRKNDRKKR

Peptide length: 33

C-terminal modification: Linear

N-terminal modification : Amidation

Non-natural peptide information:

Activity Information

Assay type : CCK-8 / WST-8

Assay time : 48-h

Activity : Cell Viability = 6.8% at 25 μM

Cell line : NCI-H2444

Cancer type : Lung Cancer

Other activity : Anticancer

Physicochemical Properties

Amino acid composition bar chart :

Molecular mass : 4084.8886 Dalton

Aliphatic index : 0.797

Instability index : 55.5485

Hydrophobicity (GRAVY) : -1.033

Isoelectric point : 12

Charge (pH 7) : 8.4964

Aromaticity : 9.090

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

Hydrophobic/hydrophilic ratio : 1.0625

hydrophobic moment : -0.777

Missing amino acid : C,E,F,H,S,Y

Most occurring amino acid : R

Most occurring amino acid frequency : 5

Least occurring amino acid : M

Least occurring amino acid frequency : 1

Structural Information

3D structure :

Secondary structure fraction (Helix, Turn, Sheet): (33., 18., 33.)

SMILES Notation: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C

Secondary Structure :

Method Prediction
GOR EECCCCCCCEEEHHHHHHHHHHHHHHHHHHTHH
Chou-Fasman (CF) EECCCCEEEEEECCCEECHHHHCHHHHHHHCCC
Neural Network (NN) CCCCCCCCCHHHHHHHHHHHHHCHHCCCCCCCC
Joint/Consensus EECCCCCCCEEEHHHHHHHHHHCHHHHHHHCCC

Molecular Descriptors and ADMET Properties

Molecular Descriptors: Click here to download

ADMET Properties: Click here to download

Cross Referencing databases

Pubmed Id :

Uniprot : Not available

PDB : Not available

CancerPPD : Not available

ApIAPDB : Not available

CancerPPD2 ID: 7827

Reference

Literature