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A non-redundant data set of nanobody-antigen crystal structures

A non-redundant data set of nanobody-antigen crystal structures is presented. The data set consists of a collection of cleaned pdb files which can be readily used as an input with most automatic analysis software. The accompanying data also include nanobody amino acid sequences with the annotated CD...

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Autores principales: Zavrtanik, Uroš, Hadži, San
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6441729/
https://www.ncbi.nlm.nih.gov/pubmed/30976633
http://dx.doi.org/10.1016/j.dib.2019.103754
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author Zavrtanik, Uroš
Hadži, San
author_facet Zavrtanik, Uroš
Hadži, San
author_sort Zavrtanik, Uroš
collection PubMed
description A non-redundant data set of nanobody-antigen crystal structures is presented. The data set consists of a collection of cleaned pdb files which can be readily used as an input with most automatic analysis software. The accompanying data also include nanobody amino acid sequences with the annotated CDR regions. In the tabular format, we provide data on the interaction properties for each complex such as number of intermolecular interactions, experimental affinity and changes of the solvent accessible area. We also include the data regarding the surface composition of all nanobody and antigen molecules (surface occurrence of each amino acid type and its secondary structure). The data may be used for further structural bioinformatic studies of nanobodies and as the reference data when performing comparisons with the conventional antibodies.
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spelling pubmed-64417292019-04-11 A non-redundant data set of nanobody-antigen crystal structures Zavrtanik, Uroš Hadži, San Data Brief Biochemistry, Genetics and Molecular Biology A non-redundant data set of nanobody-antigen crystal structures is presented. The data set consists of a collection of cleaned pdb files which can be readily used as an input with most automatic analysis software. The accompanying data also include nanobody amino acid sequences with the annotated CDR regions. In the tabular format, we provide data on the interaction properties for each complex such as number of intermolecular interactions, experimental affinity and changes of the solvent accessible area. We also include the data regarding the surface composition of all nanobody and antigen molecules (surface occurrence of each amino acid type and its secondary structure). The data may be used for further structural bioinformatic studies of nanobodies and as the reference data when performing comparisons with the conventional antibodies. Elsevier 2019-03-06 /pmc/articles/PMC6441729/ /pubmed/30976633 http://dx.doi.org/10.1016/j.dib.2019.103754 Text en © 2019 The Author(s) http://creativecommons.org/licenses/by/4.0/ This is an open access article under the CC BY license (http://creativecommons.org/licenses/by/4.0/).
spellingShingle Biochemistry, Genetics and Molecular Biology
Zavrtanik, Uroš
Hadži, San
A non-redundant data set of nanobody-antigen crystal structures
title A non-redundant data set of nanobody-antigen crystal structures
title_full A non-redundant data set of nanobody-antigen crystal structures
title_fullStr A non-redundant data set of nanobody-antigen crystal structures
title_full_unstemmed A non-redundant data set of nanobody-antigen crystal structures
title_short A non-redundant data set of nanobody-antigen crystal structures
title_sort non-redundant data set of nanobody-antigen crystal structures
topic Biochemistry, Genetics and Molecular Biology
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6441729/
https://www.ncbi.nlm.nih.gov/pubmed/30976633
http://dx.doi.org/10.1016/j.dib.2019.103754
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