Author
Listed:
- Erney Ramírez-Aportela
(Campus Univ. Autónoma de Madrid)
- David Maluenda
(Campus Univ. Autónoma de Madrid)
- Yunior C. Fonseca
(Campus Univ. Autónoma de Madrid)
- Pablo Conesa
(Campus Univ. Autónoma de Madrid)
- Roberto Marabini
(Campus Univ. Autónoma de Madrid)
- J. Bernard Heymann
(NIH)
- Jose Maria Carazo
(Campus Univ. Autónoma de Madrid)
- Carlos Oscar S. Sorzano
(Campus Univ. Autónoma de Madrid
Univ. CEU San Pablo, Campus Urb. Montepríncipe)
Abstract
In recent years, advances in cryoEM have dramatically increased the resolution of reconstructions and, with it, the number of solved atomic models. It is widely accepted that the quality of cryoEM maps varies locally; therefore, the evaluation of the maps-derived structural models must be done locally as well. In this article, a method for the local analysis of the map-to-model fit is presented. The algorithm uses a comparison of two local resolution maps. The first is the local FSC (Fourier shell correlation) between the full map and the model, while the second is calculated between the half maps normally used in typical single particle analysis workflows. We call the quality measure “FSC-Q”, and it is a quantitative estimation of how much of the model is supported by the signal content of the map. Furthermore, we show that FSC-Q may be helpful to detect overfitting. It can be used to complement other methods, such as the Q-score method that estimates the resolvability of atoms.
Suggested Citation
Erney Ramírez-Aportela & David Maluenda & Yunior C. Fonseca & Pablo Conesa & Roberto Marabini & J. Bernard Heymann & Jose Maria Carazo & Carlos Oscar S. Sorzano, 2021.
"FSC-Q: a CryoEM map-to-atomic model quality validation based on the local Fourier shell correlation,"
Nature Communications, Nature, vol. 12(1), pages 1-7, December.
Handle:
RePEc:nat:natcom:v:12:y:2021:i:1:d:10.1038_s41467-020-20295-w
DOI: 10.1038/s41467-020-20295-w
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