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Modeling SARS‐CoV‐2 proteins in the CASP‐commons experiment

Abstract

Critical Assessment of Structure Prediction (CASP) is an organization aimed at advancing the state of the art in computing protein structure from sequence. In the spring of 2020, CASP launched a community project to compute the structures of the most structurally challenging proteins coded for in the SARS-CoV-2 genome. Forty-seven research groups submitted over 3000 three-dimensional models and 700 sets of accuracy estimates on 10 proteins. The resulting models were released to the public. CASP community members also worked together to provide estimates of local and global accuracy and identify structure-based domain boundaries for some proteins. Subsequently, two of these structures (ORF3a and ORF8) have been solved experimentally, allowing assessment of both model quality and the accuracy estimates. Models from the AlphaFold2 group were found to have good agreement with the experimental structures, with main chain GDT_TS accuracy scores ranging from 63 (a correct topology) to 87 (competitive with experiment).

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Authors (89)

  • Photo of  Andriy Kryshtafovych

    Andriy Kryshtafovych

  • Photo of  John Moult

    John Moult

  • Photo of  Wendy M. Billings

    Wendy M. Billings

  • Photo of  Dennis Della Corte

    Dennis Della Corte

  • Photo of  Krzysztof Fidelis

    Krzysztof Fidelis

  • Photo of  Sohee Kwon

    Sohee Kwon

  • Photo of  Kliment Olechnovič

    Kliment Olechnovič

  • Photo of  Chaok Seok

    Chaok Seok

  • Photo of  Česlovas Venclovas

    Česlovas Venclovas

  • Photo of  Jonghun Won

    Jonghun Won

  • Photo of  Alphafold Team

    Alphafold Team

  • Photo of  Badri Adhikari

    Badri Adhikari

  • Photo of  Recep Adiyaman

    Recep Adiyaman

  • Photo of  Joaquim Aguirre-plans

    Joaquim Aguirre-plans

  • Photo of  Ivan Anishchenko

    Ivan Anishchenko

  • Photo of  Minkyung Baek

    Minkyung Baek

  • Photo of  David Baker

    David Baker

  • Photo of  Frederico Baldassarre

    Frederico Baldassarre

  • Photo of  Jacob Barger

    Jacob Barger

  • Photo of  Sutanu Bhattacharya

    Sutanu Bhattacharya

  • Photo of  Debswapna Bhattacharya

    Debswapna Bhattacharya

  • Photo of  Mor Bitton

    Mor Bitton

  • Photo of  Renzhi Cao

    Renzhi Cao

  • Photo of  Jianlin Cheng

    Jianlin Cheng

  • Photo of  Charles Christoffer

    Charles Christoffer

  • Photo of Dr hab. Cezary Czaplewski

    Cezary Czaplewski Dr hab.

  • Photo of  Zongyang Du

    Zongyang Du

  • Photo of  Arne Elofsson

    Arne Elofsson

  • Photo of  Eshel Faraggi

    Eshel Faraggi

  • Photo of  Michael Feig

    Michael Feig

  • Photo of  Narcis Fernandez-fuentes

    Narcis Fernandez-fuentes

  • Photo of  Nick Grishin

    Nick Grishin

  • Photo of  Sergei Grudinin

    Sergei Grudinin

  • Photo of  Zhiye Guo

    Zhiye Guo

  • Photo of  Yuya Hanazono

    Yuya Hanazono

  • Photo of  Demis Hassabis

    Demis Hassabis

  • Photo of  Bryce Hedelius

    Bryce Hedelius

  • Photo of  Lim Heo

    Lim Heo

  • Photo of  Naozumi Hiranuma

    Naozumi Hiranuma

  • Photo of  Cassandra Hunt

    Cassandra Hunt

  • Photo of  Ilia Igashov

    Ilia Igashov

  • Photo of  Takashi Ishida

    Takashi Ishida

  • Photo of  Robert L. Jernigan

    Robert L. Jernigan

  • Photo of  David Jones

    David Jones

  • Photo of  John Jumper

    John Jumper

  • Photo of  Maria Kadukova

    Maria Kadukova

  • Photo of  Shaun Kandathil

    Shaun Kandathil

  • Photo of  Chen Keasar

    Chen Keasar

  • Photo of  Daisuke Kihara

    Daisuke Kihara

  • Photo of  Lisa Kinch

    Lisa Kinch

  • Photo of  Yasuomi Kiyota

    Yasuomi Kiyota

  • Photo of  Andrzej Kloczkowski

    Andrzej Kloczkowski

  • Photo of  Pushmeet Kohli

    Pushmeet Kohli

  • Photo of  Mateusz Kogut

    Mateusz Kogut

  • Photo of  Elodie Laine

    Elodie Laine

  • Photo of  Cade Lilley

    Cade Lilley

  • Photo of  Jian Liu

    Jian Liu

  • Photo of  Adam Liwo

    Adam Liwo

  • Photo of  Arup Mondal

    Arup Mondal

  • Photo of  Connor J. Morris

    Connor J. Morris

  • Photo of  Liam Mcguffin

    Liam Mcguffin

  • Photo of  Alexis Molina

    Alexis Molina

  • Photo of  Tsukasa Nakamura

    Tsukasa Nakamura

  • Photo of  Baldo Oliva

    Baldo Oliva

  • Photo of  Alberto Perez

    Alberto Perez

  • Photo of  Gabriele Pozzati

    Gabriele Pozzati

  • Photo of  Daipayan Sarkar

    Daipayan Sarkar

  • Photo of  Rin Sato

    Rin Sato

  • Photo of  Torsten Schwede

    Torsten Schwede

  • Photo of  Bikash Shrestha

    Bikash Shrestha

  • Photo of  Tomer Sidi

    Tomer Sidi

  • Photo of  Gabriel Studer

    Gabriel Studer

  • Photo of  Md Hossain Shuvo

    Md Hossain Shuvo

  • Photo of  Mayuko Takeda-shitaka

    Mayuko Takeda-shitaka

  • Photo of  Yuma Takei

    Yuma Takei

  • Photo of  Genki Terashi

    Genki Terashi

  • Photo of  Kentaro Tomii

    Kentaro Tomii

  • Photo of  Yuko Tsuchiya

    Yuko Tsuchiya

  • Photo of  Kathryn Tunyasuvunakool

    Kathryn Tunyasuvunakool

  • Photo of  Bjorn Wallner

    Bjorn Wallner

  • Photo of  Tianqi Wu

    Tianqi Wu

  • Photo of  Jinbo Xu

    Jinbo Xu

  • Photo of  Yu Yamamori

    Yu Yamamori

  • Photo of  Jianyi Yang

    Jianyi Yang

  • Photo of  Lisha Ye

    Lisha Ye

  • Photo of  Chengxin Zhang

    Chengxin Zhang

  • Photo of  Yang Zhang

    Yang Zhang

  • Photo of  Wei Zheng

    Wei Zheng

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Category:
Articles
Type:
artykuły w czasopismach
Published in:
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS no. 89, pages 1987 - 1996,
ISSN: 0887-3585
Language:
English
Publication year:
2021
Bibliographic description:
Kryshtafovych A., Moult J., Billings W. M., Della Corte D., Fidelis K., Kwon S., Olechnovič K., Seok C., Venclovas Č., Won J., Team A., Adhikari B., Adiyaman R., Aguirre-Plans J., Anishchenko I., Baek M., Baker D., Baldassarre F., Barger J., Bhattacharya S., Bhattacharya D., Bitton M., Cao R., Cheng J., Christoffer C., Czaplewski C., Du Z., Elofsson A., Faraggi E., Feig M., Fernandez-Fuentes N., Grishin N., Grudinin S., Guo Z., Hanazono Y., Hassabis D., Hedelius B., Heo L., Hiranuma N., Hunt C., Igashov I., Ishida T., Jernigan R. L., Jones D., Jumper J., Kadukova M., Kandathil S., Keasar C., Kihara D., Kinch L., Kiyota Y., Kloczkowski A., Kohli P., Kogut M., Laine E., Lilley C., Liu J., Liwo A., Lubecka E., Mondal A., Morris C. J., Mcguffin L., Molina A., Nakamura T., Oliva B., Perez A., Pozzati G., Sarkar D., Sato R., Schwede T., Shrestha B., Sidi T., Studer G., Shuvo M. H., Takeda-Shitaka M., Takei Y., Terashi G., Tomii K., Tsuchiya Y., Tunyasuvunakool K., Wallner B., Wu T., Xu J., Yamamori Y., Yang J., Ye L., Zhang C., Zhang Y., Zheng W.: Modeling SARS‐CoV‐2 proteins in the CASP‐commons experiment// PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS -Vol. 89,iss. 12 (2021), s.1987-1996
DOI:
Digital Object Identifier (open in new tab) 10.1002/prot.26231
Verified by:
Gdańsk University of Technology

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