The Nucleome Data Bank: web-based resources to simulate and analyze the three-dimensional genome

Author:

Contessoto Vinícius G123ORCID,Cheng Ryan R1,Hajitaheri Arya14,Dodero-Rojas Esteban15,Mello Matheus F16,Lieberman-Aiden Erez17,Wolynes Peter G18910ORCID,Di Pierro Michele111,Onuchic José N18910

Affiliation:

1. Center for Theoretical Biological Physics, Rice University, Houston, TX 77005, USA

2. Brazilian Biorenewables National Laboratory-LNBR, Brazilian Center for Research in Energy and Materials-CNPEM, Campinas, SP 13083-100, Brazil

3. Department of Physics, São Paulo State University (UNESP), Institute of Biosciences, Humanities and Exact Sciences, São José do Rio Preto, SP 15054-000, Brazil

4. Department of Computer Science, University of Houston, Houston, TX 77204, USA

5. Theoretical and Computational Physics Laboratory, University of Costa Rica, San José 5 11501, Costa Rica

6. Chemical Engineering Department, Military Institute of Engineering, Rio de Janeiro, RJ 22290-270, Brazil

7. The Center for Genome Architecture, Department of Molecular and Human Genetics, Baylor College of Medicine, Houston, TX 77030, USA

8. Department of Physics & Astronomy, Rice University, Houston, TX 77005, USA

9. Department of Chemistry, Rice University, Houston, TX 77005, USA

10. Department of Biosciences, Rice University, Houston, TX 77005, USA

11. Department of Physics, Northeastern University, Boston, MA 02115, USA

Abstract

Abstract We introduce the Nucleome Data Bank (NDB), a web-based platform to simulate and analyze the three-dimensional (3D) organization of genomes. The NDB enables physics-based simulation of chromosomal structural dynamics through the MEGABASE + MiChroM computational pipeline. The input of the pipeline consists of epigenetic information sourced from the Encode database; the output consists of the trajectories of chromosomal motions that accurately predict Hi-C and fluorescence insitu hybridization data, as well as multiple observations of chromosomal dynamics in vivo. As an intermediate step, users can also generate chromosomal sub-compartment annotations directly from the same epigenetic input, without the use of any DNA–DNA proximity ligation data. Additionally, the NDB freely hosts both experimental and computational structural genomics data. Besides being able to perform their own genome simulations and download the hosted data, users can also analyze and visualize the same data through custom-designed web-based tools. In particular, the one-dimensional genetic and epigenetic data can be overlaid onto accurate 3D structures of chromosomes, to study the spatial distribution of genetic and epigenetic features. The NDB aims to be a shared resource to biologists, biophysicists and all genome scientists. The NDB is available at https://ndb.rice.edu.

Funder

National Science Foundation

Welch Foundation

Cancer Prevention and Research Institute of Texas

Robert A. Welch Postdoctoral Fellowship

Fundação de Amparo ã Pesquisa do Estado de São Paulo

USDA Agriculture and Food Research Initiative

NIH

Publisher

Oxford University Press (OUP)

Subject

Genetics

Reference49 articles.

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