TY - DATA T1 - Data underlying the publication: Roodmus: a toolkit for benchmarking heterogeneous electron cryo-microscopy reconstructions - Roodmus_6xm5_steered PY - 2024/10/14 AU - Maarten Joosten AU - Joel Greer AU - James Parkhurst AU - Tom Burnley AU - Arjen Jakobi UR - DO - 10.4121/eefcc341-250c-407c-a299-a4512df5f962.v1 KW - cryo-EM KW - biological macromolecules KW - single-particle averaging KW - heterogeneous reconstruction algorithms KW - molecular dynamics simulations KW - conformational trajectories N2 -

Introduction

data underlying the publication Roodmus: a toolkit for benchmarking heterogeneous electron cryo-microscopy reconstructions.

Publication DOI: https://doi.org/10.1107/S2052252524009321

Authors: M. Joosten, J. Greer, J. Parkhurst, T. Burnley, A.J. Jakobi


Description

SARS-CoV-2 spike glycoprotein monomer synthetic cryo-EM micrographs and atomic structure models. 20000 particles in 800 .mrc micrographs and 10000 .pdb models. Atomic models derived from steered molecular dynamics simulation performed in openMM using starting and target structures adapted from models with PDB id 6xm4 and 6xm5 respectively.

ER -