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Molecular Cloning and AlphaFold Modeling of Thyrotropin (ag-TSH) From the Amazonian Fish Pirarucu ()
Published 2023-02-01“…The Arapaima gigas thyrotropin (ag-TSH) model, solved by AlphaFold, was used in molecular dynamics simulations with Scleropages formosus receptor, providing similar values of free energy ΔG bind and ΔG PMF in comparison with Homo sapiens model. …”
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62
AlphaFold2 reveals commonalities and novelties in protein structure space for 21 model organisms
Published 2023-02-01“…A new protein domain classification protocol incorporating deep learning strategies for detecting sequence and structure similarities between domain is used to systematically study and analyse the predicted AlphaFold2 structural models for proteins of 21 organisms.…”
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63
Refinement of AlphaFold2 models against experimental and hybrid cryo-EM density maps
Published 2022-01-01Subjects: “…AlphaFold2…”
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64
Leveraging AlphaFold 2 as a general-purpose architecture for small molecule conformer prediction
Published 2023“…The major advantage of deep learning methods is their relatively high speeds and low costs. Here, we build on AlphaFold2’s architecture for the purpose of MCG. We explore how various architectures and loss functions modify performance for MCG. …”
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AlphaFold Accurately Predicts the Structure of Ribosomally Synthesized and Post-Translationally Modified Peptide Biosynthetic Enzymes
Published 2023-08-01Subjects: Get full text
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66
Use of an Integrated Approach Involving AlphaFold Predictions for the Evolutionary Taxonomy of <i>Duplodnaviria</i> Viruses
Published 2023-01-01Subjects: Get full text
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67
AlphaFold-Predicted Structures of KCTD Proteins Unravel Previously Undetected Relationships among the Members of the Family
Published 2021-12-01“…This scenario is rapidly changing due to the release of the protein three-dimensional models predicted by AlphaFold (AF). Here, we exploited the structural information contained in the AF database to gain insights into the relationships among the members of the KCTD family with the aim of facilitating the definition of the structural and molecular basis of key roles that these proteins play in many biological processes. …”
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68
SARS-CoV-2 receptor-binding domain deep mutational AlphaFold2 structures
Published 2023-03-01“…Abstract Leveraging recent advances in computational modeling of proteins with AlphaFold2 (AF2) we provide a complete curated data set of all single mutations from each of the 7 main SARS-CoV-2 lineages spike protein receptor binding domain (RBD) resulting in 3819X7 = 26733 PDB structures. …”
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69
Evaluation of the Effectiveness of Derived Features of AlphaFold2 on Single-Sequence Protein Binding Site Prediction
Published 2022-10-01Subjects: “…AlphaFold2…”
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70
pLDDT Values in AlphaFold2 Protein Models Are Unrelated to Globular Protein Local Flexibility
Published 2023-11-01Subjects: “…AlphaFold…”
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71
Discovering deaminases using AlphaFold2: a strategy to search for tool proteins for gene editing
Published 2024-02-01Get full text
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72
AlphaFold2 and RoseTTAFold predict posttranslational modifications. Chromophore formation in GFP-like proteins
Published 2022-01-01“…AlphaFold2 and RoseTTAfold are able to predict, based solely on their sequence whether GFP-like proteins will post-translationally form a chromophore (the part of the protein responsible for fluorescence) or not. …”
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73
AlphaFold2 and RoseTTAFold predict posttranslational modifications. Chromophore formation in GFP-like proteins.
Published 2022-01-01“…AlphaFold2 and RoseTTAfold are able to predict, based solely on their sequence whether GFP-like proteins will post-translationally form a chromophore (the part of the protein responsible for fluorescence) or not. …”
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74
New insights into the pathogenicity of TMEM165 variants using structural modeling based on AlphaFold 2 predictions
Published 2023-01-01“…Until recently, the classical membrane protein topology prediction methods were unable to provide a clear picture of the organization of TMEM165 inside the cell membrane, or to explain in a convincing manner the impact of patient and experimentally-generated mutations on the transporter function of TMEM165. In this study, AlphaFold 2 was used to build a TMEM165 model that was then refined by molecular dynamics simulation with membrane lipids and water. …”
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75
Deciphering cross-species reactivity of LAMP-1 antibodies using deep mutational epitope mapping and AlphaFold
Published 2023-12-01“…As human LAMP-1 structure has not yet been solved, we used the AlphaFold predicted structure of the full-length protein to combine with DMS data and ultimately finely map antibody epitopes. …”
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76
AlphaFold2-multimer guided high-accuracy prediction of typical and atypical ATG8-binding motifs
Published 2023-02-01Get full text
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77
Exploring Structural Diversity among Adhesion Devices Encoded by Lactococcal P335 Phages with AlphaFold2
Published 2022-11-01“…The protein structure prediction program AlphaFold2 is exquisitely adapted to unveil structural and functional details of such molecular machineries. …”
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How AlphaFold2 Predicts Conditionally Folding Regions Annotated in an Intrinsically Disordered Protein Database, IDEAL
Published 2023-01-01“…AlphaFold2 (AF2) is a protein structure prediction program which provides accurate models. …”
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80
Structural Insights into the Dimeric Form of <i>Bacillus subtilis</i> RNase Y Using NMR and AlphaFold
Published 2022-12-01Subjects: Get full text
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