DataSheet1_Identifying well-folded de novo proteins in the new era of accurate structure prediction.pdf

Supplementary Figure 1. Distributions of AlphaFold2 descriptors calculated for the BoNT dataset. Supplementary Figure 2. Distributions of RoseTTAFold descriptors calculated for the BoNT dataset. Supplementary Figure 3. Distributions of MolProbity and interface descriptors calculated for the BoNT dat...

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Detalles Bibliográficos
Autores: Peñas-Utrilla, Daniel, Marcos, Enrique
Tipo de recurso: conjunto de datos
Estado:Versión publicada
Fecha de publicación:2022
País:España
Institución:Consejo Superior de Investigaciones Científicas (CSIC)
Repositorio:DIGITAL.CSIC. Repositorio Institucional del CSIC
OAI Identifier:oai:digital.csic.es:10261/331500
Acceso en línea:http://hdl.handle.net/10261/331500
Access Level:acceso abierto
Palabra clave:De novo protein design
AlphaFold2
RoseTTAFold
Machine learning
Solubility
Protein binding
Protein folding
Protein monomer
Descripción
Sumario:Supplementary Figure 1. Distributions of AlphaFold2 descriptors calculated for the BoNT dataset. Supplementary Figure 2. Distributions of RoseTTAFold descriptors calculated for the BoNT dataset. Supplementary Figure 3. Distributions of MolProbity and interface descriptors calculated for the BoNT dataset Supplementary Figure 4. Global and local confidence scores for the AlphaFold2 and RoseTTAFold predictions for the Monomer dataset. (A) Supplementary Figure 5. Fragment quality and MolProbity descriptors calculated for the Monomer dataset. (A) Supplementary Figure 6. Properties of the homodimer interfaces predicted by AlphaFold2 for the Monomer dataset Supplementary Figure 7. Predictions of solvent exposed hydrophobicity and soluble expression for the Monomer dataset. (A) Supplementary Figure 8. Comparison between AlphaFold2 and RoseTTAFold predictions for the two datasets