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Author Details

Gaetano T Montelione
Rensselaer Polytechnic Institute
1981
365
67
Andrej Sali (CM4AI)
PMIDPaper TitleJournal TitlePublished Year
36712039Blind Assessment of Monomeric AlphaFold2 Protein Structure Models with Experimental NMR Data.bioRxiv2023
37776602Representing structures of the multiple conformational states of proteins.Curr Opin Struct Biol2023
37872703Breaking the conformational ensemble barrier: Ensemble structure modeling challenges in CASP15.Proteins2023
37257257Blind assessment of monomeric AlphaFold2 protein structure models with experimental NMR data.J Magn Reson2023
37021400Protein Folding and Dynamicsâ¿¿An Overview on the Occasion of Harold Scheraga's 100th Birthday.J Phys Chem B2023
36988562Structure Determination of Challenging Protein-Peptide Complexes Combining NMR Chemical Shift Data and Molecular Dynamics Simulations.J Chem Inf Model2023
37178478Cell-permeable chameleonic peptides: Exploiting conformational dynamics in de novo cyclic peptide design.Curr Opin Struct Biol2023
37235475Protocol for production and purification of SARS-CoV-2 3CL<sup>pro</sup>.STAR Protoc2023
35122336Structural evolution of the ancient enzyme, dissimilatory sulfite reductase.Proteins2022
35801308Oligomeric interactions maintain active-site structure in a noncooperative enzyme family.EMBO J2022
35769913AlphaFold Models of Small Proteins Rival the Accuracy of Solution NMR Structures.Front Mol Biosci2022
35545041SETD4-mediated KU70 methylation suppresses apoptosis.Cell Rep2022
36041435Accurate de novo design of membrane-traversing macrocycles.Cell2022
35930941SpecDB: A relational database for archiving biomolecular NMR spectral data.J Magn Reson2022
36353143Structural similarities between SARS-CoV2 3CL<sup>pro</sup> and other viral proteases suggest potential lead molecules for developing broad spectrum antivirals.Front Chem2022
36262477Editorial: Computational approaches for interpreting experimental data and understanding protein structure, dynamics and function relationships.Front Mol Biosci2022
34168113Role of backbone strain in de novo design of complex α/β protein structures.Nat Commun2021
33592170A common binding motif in the ET domain of BRD3 forms polymorphic structural interfaces with host and viral proteins.Structure2021
33895137ZapG (YhcB/DUF1043), a novel cell division protein in gamma-proteobacteria linking the Z-ring to septal peptidoglycan synthesis.J Biol Chem2021
33524015REDCRAFT: A computational platform using residual dipolar coupling NMR data for determining structures of perdeuterated proteins in solution.PLoS Comput Biol2021
34853475De novo protein design by deep network hallucination.Nature2021
34559429Assessment of prediction methods for protein structures determined by NMR in CASP14: Impact of AlphaFold2.Proteins2021
33984267Hepatitis C virus drugs that inhibit SARS-CoV-2 papain-like protease synergize with remdesivir to suppress viral replication in cell culture.Cell Rep2021
32511291Structural Similarity of SARS-CoV2 M[pro] and HCV NS3/4A Proteases Suggests New Approaches for Identifying Existing Drugs Useful as COVID-19 Therapeutics.ChemRxiv2020
31754723A double-stranded RNA platform is required for the interaction between a host restriction factor and the NS1 protein of influenza A virus.Nucleic Acids Res2020
31665817Evolutionary coupling saturation mutagenesis: Coevolution-guided identification of distant sites influencing Bacillus naganoensis pullulanase activity.FEBS Lett2020
31794207High-Throughput PIXE as an Essential Quantitative Assay for Accurate Metalloprotein Structural Analysis: Development and Application.J Am Chem Soc2020
33095009Tribute to Harold A. Scheraga.J Phys Chem B2020
30611430Combining Evolutionary Covariance and NMR Data for Protein Structure Determination.Methods Enzymol2019
31780431Federating Structural Models and Data: Outcomes from A Workshop on Archiving Integrative Structures.Structure2019
31436959Structural Basis by Which the N-Terminal Polypeptide Segment of <i>Rhizopus chinensis</i> Lipase Regulates Its Substrate Binding Affinity.Biochemistry2019
31603581Protein structure prediction assisted with sparse NMR data in CASP13.Proteins2019
30956130A Proteomic Screen of Neuronal Cell-Surface Molecules Reveals IgLONs as Structurally Conserved Interaction Modules at the Synapse.Structure2019
31168091De novo protein design by citizen scientists.Nature2019
30655293The copBL operon protects Staphylococcus aureus from copper toxicity: CopL is an extracellular membrane-associated copper-binding protein.J Biol Chem2019
30638538An ELISA-Based Screening Platform for Ligand-Receptor Discovery.Methods Enzymol2019
28929427Backbone and Ile-δ1, Leu, Val methyl <sup>1</sup>H, <sup>15</sup>N, and <sup>13</sup>C, chemical shift assignments for Rhizopus chinensis lipase.Biomol NMR Assign2018
30141918Minimal Heterochiral de Novo Designed 4Fe-4S Binding Peptide Capable of Robust Electron Transfer.J Am Chem Soc2018
30289697Antiparallel Coiled-Coil Interactions Mediate the Homodimerization of the DNA Damage-Repair Protein PALB2.Biochemistry2018
30617828A Hybrid Approach for Protein Structure Determination Combining Sparse NMR with Evolutionary Coupling Sequence Data.Adv Exp Med Biol2018
29638227A toolbox of immunoprecipitation-grade monoclonal antibodies to human transcription factors.Nat Methods2018
29447443Inhibitor Bound Dengue NS2B-NS3pro Reveals Multiple Dynamic Binding Modes.Biochemistry2018
29440715Effect of mitochondrial uncouplers niclosamide ethanolamine (NEN) and oxyclozanide on hepatic metastasis of colon cancer.Cell Death Dis2018
27750371Aromatic claw: A new fold with high aromatic content that evades structural prediction.Protein Sci2017
28082595Principles for designing proteins with cavities formed by curved β sheets.Science2017
28120439Multiple helical conformations of the helix-turn-helix region revealed by NOE-restrained MD simulations of tryptophan aporepressor, TrpR.Proteins2017
28731268<sup>13</sup> C metabolic flux profiling of Pichia pastoris grown in aerobic batch cultures on glucose revealed high relative anabolic use of TCA cycle and limited incorporation of provided precursors of branched-chain amino acids.FEBS J2017
28653216NMR characterization of HtpG, the E. coli Hsp90, using sparse labeling with <sup>13</sup>C-methyl alanine.J Biomol NMR2017
28066922X-ray crystal structure of the N-terminal region of Moloney murine leukemia virus integrase and its implications for viral DNA recognition.Proteins2017
27050687Outcome of the First wwPDB/CCDC/D3R Ligand Validation Workshop.Structure2016
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Collaborators

School of Public Health, Capital Medical University
Co-authored papers 132
Center for Advanced Biotechnology and Medicine, The State University of New Jersey
Co-authored papers 120
Center for Advanced Biotechnology and Medicine, The State University of New Jersey
Co-authored papers 63
Columbia University
Co-authored papers 39
Miami University
Co-authored papers 38
Robert Wood Johnson Medical School, The State University of New Jersey
Co-authored papers 36
Columbia University
Co-authored papers 36
Technical University of Munich (TUM)
Co-authored papers 27
University of Washington
Co-authored papers 27
Robert Wood Johnson Medical School, Rutgers University
Co-authored papers 22
Pacific Northwest National Laboratory
Co-authored papers 20
Columbia University
Co-authored papers 16
Co-authored papers 16
Center for Advanced Biotechnology and Medicine, The State University of New Jersey
Co-authored papers 15
University of Toronto
Co-authored papers 14
Columbia University Irving Medical Center
Co-authored papers 13
Co-authored papers 13
Co-authored papers 12
The Ohio State University
Co-authored papers 11
Yale University
Co-authored papers 10
Center for Structural Biology of Infectious Diseases, University of Chicago
Co-authored papers 10
The University of Texas MD Anderson Cancer Center
Co-authored papers 9
University of Wisconsin-Madison
Co-authored papers 9
The State University of New Jersey
Co-authored papers 9
National Institute of Diabetes and Digestive and Kidney Diseases (NIDDK)
Co-authored papers 8
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Center for Advanced Biotechnology and Medicine, Rutgers University
Co-authored papers 8
The State University of New Jersey
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Guizhou Medical University
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Center for Integrated Protein Science, Technische Universitat Munchen
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