Literature DB >> 33623015

Local computational methods to improve the interpretability and analysis of cryo-EM maps.

Satinder Kaur1, Josue Gomez-Blanco1, Ahmad A Z Khalifa1, Swathi Adinarayanan1, Ruben Sanchez-Garcia2, Daniel Wrapp3, Jason S McLellan3, Khanh Huy Bui1, Javier Vargas4.   

Abstract

Cryo-electron microscopy (cryo-EM) maps usually show heterogeneous distributions of B-factors and electron density occupancies and are typically B-factor sharpened to improve their contrast and interpretability at high-resolutions. However, 'over-sharpening' due to the application of a single global B-factor can distort processed maps causing connected densities to appear broken and disconnected. This issue limits the interpretability of cryo-EM maps, i.e. ab initio modelling. In this work, we propose 1) approaches to enhance high-resolution features of cryo-EM maps, while preventing map distortions and 2) methods to obtain local B-factors and electron density occupancy maps. These algorithms have as common link the use of the spiral phase transformation and are called LocSpiral, LocBSharpen, LocBFactor and LocOccupancy. Our results, which include improved maps of recent SARS-CoV-2 structures, show that our methods can improve the interpretability and analysis of obtained reconstructions.

Entities:  

Year:  2021        PMID: 33623015     DOI: 10.1038/s41467-021-21509-5

Source DB:  PubMed          Journal:  Nat Commun        ISSN: 2041-1723            Impact factor:   14.919


  1 in total

1.  Lipid Interactions of a Ciliary Membrane TRP Channel: Simulation and Structural Studies of Polycystin-2.

Authors:  Qinrui Wang; Robin A Corey; George Hedger; Prafulla Aryal; Mariana Grieben; Chady Nasrallah; Agnese Baronina; Ashley C W Pike; Jiye Shi; Elisabeth P Carpenter; Mark S P Sansom
Journal:  Structure       Date:  2019-12-02       Impact factor: 5.871

  1 in total
  11 in total

Review 1.  Emerging Themes in CryoEM─Single Particle Analysis Image Processing.

Authors:  Jose Luis Vilas; Jose Maria Carazo; Carlos Oscar S Sorzano
Journal:  Chem Rev       Date:  2022-07-04       Impact factor: 72.087

2.  Structures of human mGlu2 and mGlu7 homo- and heterodimers.

Authors:  Juan Du; Dejian Wang; Hongcheng Fan; Chanjuan Xu; Linhua Tai; Shuling Lin; Shuo Han; Qiuxiang Tan; Xinwei Wang; Tuo Xu; Hui Zhang; Xiaojing Chu; Cuiying Yi; Peng Liu; Xiaomei Wang; Yu Zhou; Jean-Philippe Pin; Philippe Rondard; Hong Liu; Jianfeng Liu; Fei Sun; Beili Wu; Qiang Zhao
Journal:  Nature       Date:  2021-06-16       Impact factor: 49.962

3.  Assessing the Mobility of Severe Acute Respiratory Syndrome Coronavirus-2 Spike Protein Glycans by Structural and Computational Methods.

Authors:  Soledad Stagnoli; Francesca Peccati; Sean R Connell; Ane Martinez-Castillo; Diego Charro; Oscar Millet; Chiara Bruzzone; Asis Palazon; Ana Ardá; Jesús Jiménez-Barbero; June Ereño-Orbea; Nicola G A Abrescia; Gonzalo Jiménez-Osés
Journal:  Front Microbiol       Date:  2022-04-15       Impact factor: 5.640

4.  Structure of the human SAGA coactivator complex.

Authors:  Dominik A Herbst; Meagan N Esbin; Robert K Louder; Claire Dugast-Darzacq; Gina M Dailey; Qianglin Fang; Xavier Darzacq; Robert Tjian; Eva Nogales
Journal:  Nat Struct Mol Biol       Date:  2021-11-22       Impact factor: 15.369

5.  Processive cleavage of substrate at individual proteolytic active sites of the Lon protease complex.

Authors:  Shanshan Li; Kan-Yen Hsieh; Chiao-I Kuo; Shih-Chieh Su; Kai-Fa Huang; Kaiming Zhang; Chung-I Chang
Journal:  Sci Adv       Date:  2021-11-10       Impact factor: 14.136

6.  Structural basis of neuropeptide Y signaling through Y1 receptor.

Authors:  Chaehee Park; Jinuk Kim; Seung-Bum Ko; Yeol Kyo Choi; Hyeongseop Jeong; Hyeonuk Woo; Hyunook Kang; Injin Bang; Sang Ah Kim; Tae-Young Yoon; Chaok Seok; Wonpil Im; Hee-Jung Choi
Journal:  Nat Commun       Date:  2022-02-14       Impact factor: 17.694

7.  CryoETGAN: Cryo-Electron Tomography Image Synthesis via Unpaired Image Translation.

Authors:  Xindi Wu; Chengkun Li; Xiangrui Zeng; Haocheng Wei; Hong-Wen Deng; Jing Zhang; Min Xu
Journal:  Front Physiol       Date:  2022-03-04       Impact factor: 4.566

Review 8.  Simulation and Machine Learning Methods for Ion-Channel Structure Determination, Mechanistic Studies and Drug Design.

Authors:  Zhengdan Zhu; Zhenfeng Deng; Qinrui Wang; Yuhang Wang; Duo Zhang; Ruihan Xu; Lvjun Guo; Han Wen
Journal:  Front Pharmacol       Date:  2022-06-28       Impact factor: 5.988

9.  DeepEMhancer: a deep learning solution for cryo-EM volume post-processing.

Authors:  Ruben Sanchez-Garcia; Josue Gomez-Blanco; Ana Cuervo; Jose Maria Carazo; Carlos Oscar S Sorzano; Javier Vargas
Journal:  Commun Biol       Date:  2021-07-15

10.  Structural Analysis of Botulinum Neurotoxins Type B and E by Cryo-EM.

Authors:  Sara Košenina; Markel Martínez-Carranza; Jonathan R Davies; Geoffrey Masuyer; Pål Stenmark
Journal:  Toxins (Basel)       Date:  2021-12-23       Impact factor: 4.546

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