Metal Binding Sites in Plant Soluble Inorganic Pyrophosphatases. An Example of the Use of ROSETTA Design and Hidden Markov Models to Guide the Homology Modeling of Proteins

Authors

  • Luis Rosales-León Rosales-León Universidad Nacional Autónoma de México
  • Eric Edmundo Hernández-Domínguez Universidad Nacional Autónoma de México
  • Samantha Gaytán-Mondragón Universidad Nacional Autónoma de México
  • Rogelio Rodríguez-Sotres Universidad Nacional Autónoma de México

DOI:

https://doi.org/10.29356/jmcs.v56i1.271

Keywords:

Protein 3D structure, comparative structural modeling, pyrophosphatase EC 3.6.1.1

Abstract

In contrast to their counterparts in bacteria and animals the soluble inorganic pyrophosphatases from plant cells are active as monomers. The isoforms 1 and 4 from Arabidopsis thaliana have been characterized with more detail, but their three-dimensional structure is unavailable. Here, a recently published protocol (ROSETTA design-HMMer), is used to guide well-known techniques for homology-modeling, in the production of reliable models for the three-dimensional structure of these two arabidopsis isoforms. Their interaction with magnesium ions and pyrophosphate is analyzed in silicoin silico.

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Author Biographies

Luis Rosales-León Rosales-León, Universidad Nacional Autónoma de México

Facultad de Medicina

Eric Edmundo Hernández-Domínguez, Universidad Nacional Autónoma de México

Facultad de Química Departamento de Bioquímica

Samantha Gaytán-Mondragón, Universidad Nacional Autónoma de México

Facultad de Química Departamento de Bioquímica

Rogelio Rodríguez-Sotres, Universidad Nacional Autónoma de México

Facultad de Química Departamento de Bioquímica

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Published

2017-10-12