[HTML][HTML] MARTINI-based protein-DNA coarse-grained HADDOCKing
RV Honorato, J Roel-Touris… - Frontiers in molecular …, 2019 - frontiersin.org
… The system is modeled using MARTINI topologies and … body docking and semi-flexible
refinement stages of HADDOCK, … this protocol using 44 complexes from the protein-DNA docking …
refinement stages of HADDOCK, … this protocol using 44 complexes from the protein-DNA docking …
Docking algorithms and scoring functions
A Afanasyeva, C Nagao, K Mizuguchi - … Methods, Analysis and …, 2020 - World Scientific
… Finally, we discuss the vexing issue of structural flexibility and the solutions that have been
… Information-driven proteinDNA docking using HADDOCK: It is a matter of flexibility. Nucleic …
… Information-driven proteinDNA docking using HADDOCK: It is a matter of flexibility. Nucleic …
Docking approaches for modeling multi-molecular assemblies
M Rosell, J Fernández-Recio - Current opinion in structural biology, 2020 - Elsevier
… The pioneering HADDOCK [16], as well as other protein–protein docking methods, such as
… other docking methods, especially for flexible cases. For highly flexible proteins, the docking …
… other docking methods, especially for flexible cases. For highly flexible proteins, the docking …
Molecular docking of Enterocin-P peptide with DNA: an in silico study
SZ Mousavi, A Javadmanesh - The 1st International and the 10th …, 2022 - profdoc.um.ac.ir
… and modelling DNA–protein complexes has been developed with HADDOCK server [3]. …
flexibility of all DNA nucleotides and the residues of the protein at the predicted interface. Using …
flexibility of all DNA nucleotides and the residues of the protein at the predicted interface. Using …
Rational design of an XNA ligase through docking of unbound nucleic acids to toroidal proteins
… docking runs, the active residues were set to be semi-flexible. Each subunit was then surface
docked on the refined duplex using … protocol for protein–DNA docking in HADDOCK is not …
docked on the refined duplex using … protocol for protein–DNA docking in HADDOCK is not …
[HTML][HTML] Definition of the Binding Architecture to a Target Promoter of HP1043, the Essential Master Regulator of Helicobacter pylori
… a data-driven protein-DNA docking. Results suggested that, … Considering that the flexible
linker is only six residues long, … obtained using the data-driven docking program HADDOCK …
linker is only six residues long, … obtained using the data-driven docking program HADDOCK …
[HTML][HTML] Structural Characterization of the Interaction of Hypoxia Inducible Factor-1 with Its Hypoxia Responsive Element at the −964G > A Variation Site of the HLA-G …
CC Alves, EA Donadi, S Giuliatti - International Journal of Molecular …, 2021 - mdpi.com
… −964G/A alleles using x3DNA. Protein-DNA docking was performed using the HADDOCK
v2.4 … interaction induces changes in DNA double helix geometry due to DNA flexibility and the …
v2.4 … interaction induces changes in DNA double helix geometry due to DNA flexibility and the …
Profiling the disintegration of BRPs released by massive wasp stings using serratiopeptidase: An in-silico insight
A Dhiman, R Purohit - Computers in Biology and Medicine, 2023 - Elsevier
… used HADDOCK v2.4 (High Ambiguity Driven Protein-Protein DOCKing) an information-driven
docking … HADDOCK is a flexible docking approach for designing biomolecular complexes …
docking … HADDOCK is a flexible docking approach for designing biomolecular complexes …
[引用][C] On the study of biomolecular interactions at different resolutions: Does size matter?
JL Roel Touris - 2021 - Utrecht University
Structure, dynamics, and function of SrnR, a transcription factor for nickel-dependent gene expression
… A second HADDOCK docking round was then carried out … semi-flexible refinement stage to
prevent helical deformation. … information on the SgSrnR protein–DNA interaction, we inferred …
prevent helical deformation. … information on the SgSrnR protein–DNA interaction, we inferred …