Which Software Is Commonly Used for the Circular Dichroism Analysis of Proteins
Protein circular dichroism (CD) analysis is a widely used technique for investigating the secondary structure of proteins. To interpret experimental CD spectra, specialized software is often employed. Commonly used tools include:
1. DichroWeb
An online platform that offers multiple algorithms for estimating the secondary structure content of proteins. Users can upload their CD spectral data, select an appropriate algorithm and reference dataset, and receive predictions of secondary structure composition.
2. CDPro
A widely used, free software suite that includes three analysis programs—CONTIN, SELCON3, and CDSSTR—designed to estimate the proportion of protein secondary structure components and the associated measurement errors.
3. BESTSEL
An online analysis tool capable of estimating both standard and mixed secondary structure elements in proteins. In addition to common structural motifs such as α-helices, β-sheets, and random coils, BESTSEL is also capable of analyzing β-bridges, π-helices, and other structural features.
These software tools are typically used to compute the following parameters:
1. Proportion of Protein Secondary Structure
Including elements such as α-helices, β-sheets, β-turns, and random coils.
2. Thermal Stability
Derived from CD measurements conducted at different temperatures.
3. Structural Changes
Analyzing how protein structure varies under differing conditions, such as changes in pH, temperature, or ionic concentration.
4. Protein Interactions
Evaluating structural alterations resulting from interactions with other molecules, including ligands, DNA, and RNA.
Such information is critical for understanding the functional properties and stability of proteins. However, it is important to note that while CD provides valuable insights into secondary structure, it does not offer detailed information about tertiary or quaternary structures, which necessitates complementary methods such as nuclear magnetic resonance (NMR) spectroscopy or X-ray crystallography.
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