Radius of Gyration (Rg) Analysis

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Radius of Gyration (Rg) Analysis

CD ComputaBio is a pioneering organization providing specialized services in the field of computer-aided drug design (CADD). One of our innovative services is centered around the important concept of Radius Analysis (Rg). Our expertise ensures comprehensive assistance in performing Rg analysis effectively, thus helping to predict the behavior of macromolecules in solution and to better understand their structural features.

Introduction of Radius of Gyration (Rg) Analysis

Radius of gyration (Rg) is a pivotal parameter in structural biology and computational chemistry used to characterize the size and shape of biomolecules based on their atomic coordinates. The Rg value represents the root mean square distance of a collection of atoms from their common center of mass. By analyzing Rg, researchers can gain critical information about the compactness, flexibility, and conformational changes of macromolecular systems, offering valuable insights into protein folding, ligand binding, and molecular dynamics.

Fig 1. Radius of Gyration (Rg) AnalysisFigure 1. Radius of Gyration (Rg) Analysis.( Pimavera R, et al. 2014)

Our Service

Fig 2. Rg Calculation for Complexes

Rg Calculation for Biomolecules and Complexes

Our team calculates the Rg to evaluate the size, compactness, and spatial domain of biomolecules and complexes.

Fig 3. Rg Simulation Services

End-to-End Rg Simulation Services

We provide end-to-end simulation services that include Rg calculation, dynamic simulations, and data analysis, supporting the drug discovery process.

Fig 4. Ligand-Protein Interaction Analysis

Ligand-Protein Interaction Studies

Investigating the impact of ligand binding on protein structures using Rg as a benchmark for structural perturbations.

Fig 5. Structural Dynamics Analysis

Structural Dynamics Assessment

We can assess the dynamic behavior and conformational changes of biomolecules by Rg analysis.

The Process of Radius of Gyration (Rg) Analysis

Data Preparation - Collecting and processing atomic coordinates of biomolecules for Rg calculations.

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Rg Calculation - Utilizing mathematical algorithms to determine the Rg value based on the spatial distribution of atoms.

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Structural Interpretation - Analyzing Rg values in the context of structural features, compactness, and flexibility of biomolecules.

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Comparative Studies - Contrasting Rg profiles across different states or conditions to elucidate structural changes and dynamics.

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Approach to Radius of Gyration (Rg) Analysis

Multi-Scale Analysis

We perform Rg analysis at different levels of molecular complexity to capture local and global structural features.

Integration with experimental data

We compare Rg calculations with experimental data to validate structural dynamics and conformational changes.

Visualization Tools

We utilize interactive visualization tools to effectively display Rg data and facilitate its interpretation by our clients.

Advantages of Our Services

Enhanced Decision-Making

Inform drug design strategies and target identification by leveraging Rg data to understand molecular behaviors.

Expert Guidance

Benefit from the expertise of our computational chemistry specialists with a deep understanding of Rg analysis techniques.

Cost-Effective Solutions

Access high-quality Rg analysis services at competitive rates to support your research initiatives effectively.

Radius of Gyration (Rg) analysis is a vital tool in the realm of drug design and molecular dynamics. It grants valuable information about a molecule's shape, structure, and behavior. At CD ComputaBio, we elevate your research and drug discovery process with our exceptional quality services, adopting a customer-centric approach to cater to your diverse project requirements. Trust us for reliable, top-grade, and time-efficient Rg analysis solutions.

References:

  1. Primavera R, Barbacane R C, Congia M, et al. Laser diffraction and light scattering techniques for the analysis of food matrices. Adv. Food Saf. Health, 2014, 6: 40-60.
  2. Vega-Paz A, Guevara-Rodríguez F J, Palomeque-Santiago J F, et al. Polymer weight determination from numerical and experimental data of the reduced viscosity of polymer in brine. Revista mexicana de física, 2019, 65(4): 321-327.
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