Amino Acid Composition Distribution Research Articles

Supersecondary structure prediction using Chou's pseudo amino acid composition

Supersecondary structures (SSSs) are the building blocks of protein 3D structures. Accurate prediction of SSSs can be one important step toward building a tertiary structure from the specified secondary structure. How to improve the accuracy of prediction of SSSs by effectively incorporating the sequence order effects is an important and challenging problem. Based on a different form of Chou's pseudo amino acid composition, a novel approach for feature representation of SSSs is proposed. Amino acid basic compositions, dipeptide components, and amino acid composition distribution are incorporated to represent the compositional features of proteins. Each supersecondary structural motif is characterized as a vector of 36 dimensions. In addition, we propose a novel prediction system by using SVM and IDQD algorithm as classifiers. Our method is trained and tested on ArchDB40 dataset containing 3088 proteins. The highest overall accuracy for the training dataset and the independent testing dataset are 77.7 and 69.4%, respectively.

β‐Hairpin prediction with quadratic discriminant analysis using diversity measure

On the basis of the features of protein sequential pattern, we used the method of increment of diversity combined with quadratic discriminant analysis (IDQD) to predict beta-hairpins motifs in protein sequences. Three rules are used to extract the raw beta-beta motifs sequential patterns for fixed-length. Amino acid basic compositions, dipeptide components, and amino acid composition distribution are combined to represent the compositional features. Eighteen feature variables on a sequential pattern to be predicted are defined in terms of ID. They are integrated in a single formal framework given by IDQD. The method is trained and tested on ArchDB40 dataset containing 3088 proteins. The overall accuracy of prediction and Matthew's correlation coefficient for the independent testing dataset are 81.7% and 0.60, respectively. In addition, a higher accuracy of 84.5% and Matthew's correlation coefficient of 0.68 for the independent testing dataset are obtained on a dataset previously used by Kumar et al. (Nucleic Acids Res 2005, 33, 154), which contains 2088 proteins. For a fair assessment of our method, the performance is also evaluated on all 63 proteins used in CASP6. The overall accuracy of prediction is 74.2% for the independent testing dataset.

Predicting the cofactors of oxidoreductases based on amino acid composition distribution and Chou's amphiphilic pseudo-amino acid composition

Predicting the cofactors of oxidoreductases plays an important role in inferring their catalytic mechanism. Feature extraction is a critical part in the prediction systems, requiring raw sequence data to be transformed into appropriate numerical feature vectors while minimizing information loss. In this paper, we present an amino acid composition distribution method for extracting useful features from primary sequence, and the k-nearest neighbor was used as the classifier. The overall prediction accuracy evaluated by the 10-fold cross-validation reached 90.74%. Comparing our method with other eight feature extraction methods, the improvement of the overall prediction accuracy ranged from 3.49% to 15.74%. Our experimental results confirm that the method we proposed is very useful and may be used for other bioinformatical predictions. Interestingly, when features extracted by our method and Chou's amphiphilic pseudo-amino acid composition were combined, the overall accuracy could reach 92.53%.

Using pseudo amino acid composition to predict protein subcellular location: approached with amino acid composition distribution

In the Post Genome Age, there is an urgent need to develop the reliable and effective computational methods to predict the subcellular localization for the explosion of newly found proteins. Here, a novel method of pseudo amino acid (PseAA) composition, the so-called "amino acid composition distribution" (AACD), is introduced. First, a protein sequence is divided equally into multiple segments. Then, amino acid composition of each segment is calculated in series. After that, each protein sequence can be represented by a feature vector. Finally, the feature vectors of all sequences thus obtained are further input into the multi-class support vector machines to predict the subcellular localization. The results show that AACD is quite effective in representing protein sequences for the purpose of predicting protein subcellular localization.