Home

News

Research

People

The lab

Publications

Downloads

Contact us

Resources


2024

59)

Burns, D., Venditti, V. & Potoyan, D.A. (2024). Illuminating protein allostery by Chemically Accurate Contact Response Analysis (ChACRA). J. Chem. Theory Comput. in Press.

PDF

58)

Burns, D., Khatiwada, B., Singh, A., Purslow, J.A., Potoyan, D.A. & Venditti, V. (2024). An α-ketoglutarate conformational switch controls iron accessibility, activation and substrate selection of the human FTO protein. Proc. Natl. Acad. Sci. USA 121, e2404457121.

PDF

57)

Sedinkin, S.L., Roche, J. & Venditti, V.. (2024). Elucidation of the mechanisms of inter-domain coupling in the monomeric state of Enzyme I by high-pressure NMR. J. Mol. Biol. 436, 168553.

PDF


2023

56)

An, Y., Chatterjee, P., Naik, P., Banerjee, S., Huang, W., Slowing, I.I. & Venditti, V. (2023). Hydrogen spillover and substrate-support hydrogen bonding mediate hydrogenation of phenol catalyzed by palladium on reducible metal oxides. Chem. Sci. 14, 14166–14175.

PDF

55)

Burns, D., Venditti, V., & Potoyan, D.A. (2023). Temperature-Sensitive Contact Modes Allosterically Gate TRPV3. PLoS Comput. Biol. 19, e1011545.

PDF

54)

Sedinkin, S.L., Burns, D., Shukla, D. Potoyan, D.A., & Venditti, V. (2023). Solution structure ensembles of the open and closed forms of the ~130 kDa Enzyme I via AlphaFold modeling, Coarse Grained simulations and NMR. J. Am. Chem. Soc. 145, 13347-13356.

PDF

53)

Singh, A., Burns, D., Sedinkin, S.L., VanVeller, B., Potoyan, D.A., & Venditti, V. (2023). Protein conformational dynamics underlie selective recognition of thermophilic over mesophilic Enzyme I by a substrate analogue. Biomolecules 13, 160.

PDF


2022

52)

Burns, D., Singh, A., Venditti, V., & Potoyan, D.A. (2022). Temperature-sensitive contacts in disordered loops tune Enzyme I activity. Proc. Natl. Acad. Sci. USA 119, e2210537119.

PDF

51)

An, Y., Sedinkin, S.L., & Venditti, V. (2022). Solution NMR methods for structural and thermodynamic investigation of nanoparticle adsorption equilibria. Nanoscale Adv. 4, 2583-2607.

PDF

50)

Khatiwada, B., Nguyen, T.T., Purslow, J.A., & Venditti, V. (2022). Solution structure ensemble of human obesity-associated protein FTO reveals druggable surface pockets at the interface between the N- and C-terminal domain. J. Biol. Chem. 298, 101907.

PDF

49)

Lisi, P.G., Rivalta, I., & Venditti, V. (2022). Editorial: structural and dynamic aspects of protein function and allostery. Front. Mol. Biosci. 9, 876499.

PDF


2021

48)

Naik, P.J., An, Y., Sedinkin, S., Mashing, H., Freppon, D., Smith, E.A., Venditti, V., & Slowing, I.I. (2021). Non-innocent role of the ceria support in Pd-catalyzed halophenol hydrodehalogenation. ACS Catal. 11, 10553-10564.

PDF

47)

Purslow, J.A., Nguyen, T.T., Khatiwada, B., Singh, A., & Venditti, V. (2021). N6-methyladenosine binding induces a metal-centered rearrangement that activates the human RNA demethylase Alkbh5. Sci. Adv. 7, eabi8215.

PDF

46)

Purslow, J.A., Thimmesch, J.N., Sivo, V., Nguyen, T.T., Khatiwada, B., Dotas, R.R., & Venditti, V. (2021). A single point mutation controls the rate of interconversion between the g+ and g- rotamers of the Histidine 189 Χ2 angle that activates bacterial Enzyme I for catalysis. Front. Mol. Biosci. 8, 699203.

PDF

45)

Nguyen, T.T., Ghirlando, R., Roche, J., & Venditti, V. (2021). Structure elucidation of the elusive Enzyme I monomer reveals the molecular mechanisms linking oligomerization and enzymatic activity. Proc. Natl. Acad. Sci. USA 118, e2100298118.

PDF

44)

Singh, A., Purslow, A.J., & Venditti, V. (2021). 15N CPMG relaxation dispersion for the investigation of protein conformational dynamics on the µs-ms timescale. J. Vis. Exp. 170, e62395.

PDF


2020

43)

Sedinkin, S.L., An, Y., Naik, P., Slowing, I.I., & Venditti, V. (2020). An organogel library for solution NMR analysis of nanoparticle suspensions in non-aqueous samples. J. Magn. Reson. 321, 106874.

PDF

42)

An, Y., Naik, P., Slowing, I.I., & Venditti, V. (2020). Substrate-support interactions mediate hydrogenation of phenolic compounds by Pd/CeO2 nanorods. ACS Appl. Nano Mater. 13, 11282–11288.

PDF

41)

Ryan, V.H., Watters, S., Amaya, J., Khatiwada, B., Venditti, V., Naik, M.T., & Fawzi, N.L. (2020). Weak binding to the A2RE RNA rigidifies hnRNPA2 RRMs and reduces liquid-liquid phase separation and aggregation. Nucl. Acids Res. 48, 10542-10554.

PDF

40)

Nguyen, T.T., & Venditti, V. (2020). An allosteric pocket for inhibition of bacterial Enzyme I identified by NMR-based fragment screening. J. Struct. Biol. X 4, 100034.

PDF

39)

Dotas, R.R., Nguyen, T.T., Stewart Jr., C.E., Ghirlando, R., Potoyan, D.A., & Venditti, V. (2020). Hybrid thermophilic/mesophilic enzymes reveal a role for conformational disorder in regulation of bacterial Enzyme I. J. Mol. Biol. 432, 4481-4498.

PDF

38)

Egner, T.K., Naik, P., An, Y., Venkatesh, A., Rossini, A.J., Slowing, I.I., & Venditti, V. (2020). 'Surface Contrast' NMR reveals non-innocent role of support in Pd/CeO2 catalyzed phenol hydrogenation. ChemCatChem 12, 4160-4166.

PDF

37)

Purslow, J.A., Khatiwada, B., Bayro, M.J., & Venditti, V. (2020). NMR Methods for Structural Characterization of Protein-Protein Complexes. Front. Mol. Biosci. 7, 9.

PDF

36)

Khatiwada, B., Purslow, J.A., Underbakke, E.S., & Venditti, V. (2020). N-terminal fusion of the N-terminal domain of bacterial Enzyme I facilitates recombinant expression and purification of the human RNA demethylases FTO and Alkbh5. Protein Expr. Purif. 167, 105540.

PDF


2019

35)

Dotas, R.R., & Venditti, V. (2019). Resonance assignment of the 128 kDa Enzyme I dimer from Thermoanaerobacter tengcongensis. Biomol. NMR Assign. 13, 287-293.

PDF

34)

Ma, L., Shi, Y., Siemianowski, O., Yuan, B., Egner, T.K., Mirnezami, S.V., Lind, K.R., Ganapathysubramaniam, B., Venditti, V., & Cademartiri, L. (2019). Hydrogel-based “transparent soils” for root phenotyping in vivo. Proc. Natl. Acad. Sci. USA 116, 11063-11068.

PDF


2018

33)

Purslow, J.A., Nguyen, T.T., Egner, T.K., Dotas, R.R., Khatiwada, B., & Venditti, V. (2018). Active site breathing of human Alkbh5 revealed by solution NMR and accelerated Molecular Dynamics. Biophys. J. 115, 1895-1905.

PDF

32)

Yuan, B., Egner, T.K., Venditti, V., & Cademartiri, L. (2018). Sustainable scalable synthesis of sulfide nanocrystals at low cost with an ionic liquid sulfur precursor. Nat. Commun. 9, 4078.

PDF

31)

Purslow, J.A., & Venditti, V. (2018). 1H, 15N, 13C backbone resonance assignment of human Alkbh5. Biomol. NMR Assign. 12, 297-301.

PDF

30)

Evangelidis, T., Nerli, S., Novácek, J., Brereton, A.E., Karplus, P.A., Dotas, R.R., Venditti, V., Sgourakis, N.G., & Tripsianes, K. (2018). Automated NMR resonance assignments and structure determination using a minimal set of 4D spectra. Nat. Commun. 9, 384.

PDF

29)

Nguyen, T.T., Ghirlando, R., & Venditti, V. (2018). The oligomerization state of bacterial enzyme I (EI) determines EI’s allosteric stimulation or competitive inhibition by α-ketoglutarate. J. Biol. Chem. 293, 2631-2639.

PDF

28)

Venditti, V., & Fawzi, N.L. (2018). Probing the atomic structure of transient protein contacts by paramagnetic relaxation enhancement solution NMR. Methods Mol. Biol. 1688, 243-255.

PDF

27)

Dotas, R.R., & Venditti, V. (2018). 1H, 15N, 13C backbone resonance assignment of the C-terminal domain of Enzyme I from Thermoanaerobacter Tengcongensis. Biomol. NMR Assign. 12, 103-106.

PDF


2017

26)

Egner, T.K., Naik, P., Nelson, N.C., Slowing, I.I., & Venditti, V. (2017). Mechanistic insights into nanoparticle surface adsorption by solution NMR spectroscopy in an aqueous gel. Angew. Chem. Int. Ed. 56, 9802-9806.

PDF


Before ISU

25)

Venditti, V., Egner, T.K., & Clore, G.M. (2016). Hybrid approaches to structural characterization of conformational ensembles of complex macromolecular systems combining NMR residual dipolar couplings and solution X-ray scattering. Chem. Rev. 116, 6305-6322.

PDF

24)

Venditti, V., Schwieters, C.D., Grishaev, A. & Clore, G.M. (2015). Dynamic equilibrium between closed and partially-closed states of the bacterial Enzyme I unveiled by solution NMR and X-ray scattering. Proc. Natl. Acad. Sci. USA 112, 11565-11570.

PDF

23)

Venditti, V., Tugarinov, V., Schwieters, C.D., Grishaev, A. & Clore, G.M. (2015). Large interdomain rearrangement triggered by suppression of micro- to millisecond dynamics in bacterial Enzyme I. Nat. Commun. 6, 5960.

PDF

22)

Tugarinov, V., Venditti, V. & Clore, G.M. (2014). A NMR experiment for simultaneous correlations of valine and leucine/isoleucine methyls with carbonyl chemical shifts in proteins. J. Biomol. NMR 58, 1-8.

PDF

21)

Clore, G.M. & Venditti, V. (2013). Structure, dynamics and biophysics of the cytoplasmic protein complexes of the bacterial phosphoenolpyruvate:sugar phosphotransferase system. Trends Biochem. Sci. 38, 515-530.

PDF

20)

Venditti, V., Ghirlando, R. & Clore, G.M. (2013). Structural basis for enzyme I inhibition by α-ketoglutarate. ACS Chem. Biol. 8, 1232-1240.

PDF

19)

Venditti, V. & Clore, G.M. (2012). Conformational selection and substrate binding regulate the monomer/dimer equilibrium of the C-terminal domain of Escherichia coli enzyme I. J. Biol. Chem. 287, 26989-26998.

PDF

18)

Bernini, A., Spiga, O., Venditti, V., Prischi, F., Botta, M., Croce, G., Tong, A.P., Wong, W.T. & Niccolai, N. (2012). The use of a ditopic Gd(III) paramagnetic probe for investigating α-bungarotoxin surface accessibility. J. Inorg. Biochem. 112, 25-31.

PDF

17)

Venditti, V., Fawzi, N.L. & Clore, G.M. (2012). An efficient protocol for incorporation of an unnatural amino acid in perdeuterated recombinant proteins using glucose-based media. J. Biomol. NMR 52, 191-195.

PDF

16)

Venditti, V., Fawzi, N.L. & Clore, G.M. (2011). Automated sequence- and stereo-specific assignment of methyl-labeled proteins by paramagnetic relaxation and methyl-methyl nuclear overhauser enhancement spectroscopy. J. Biomol. NMR 51, 319-328.

PDF

15)

Spiga, O., Summa, D., Cirri, S., Bernini, A., Venditti, V., De Chiara, M., Priora, R., Frosali, S., Margaritis, A., Di Giuseppe, D., Di Simplicio, P. & Niccolai, N. (2011). A structurally driven analysis of thiol reactivity in mammalian albumins. Biopolymers 95, 278-285.

PDF

14)

Venditti, V., Clos, L.II, Niccolai, N. & Butcher, S.E. (2009). Minimum energy path for a U6 RNA conformational change involving protonation, base pair rearrangement and base flipping. J. Mol. Biol. 391, 894-905.

PDF

13)

Bernini, A., Venditti, V., Spiga, O. & Niccolai, N. (2009). Probing protein surface accessibility with solvent and paramagnetic molecules. Prog. Nucl. Mag. Res. Sp. 54, 278-289.

PDF

12)

Bernini, A., Venditti, V., Spiga, O., Ciutti, A., Prischi, F., Consonni, R., Zetta, L., Arosio, I., Fusi, P., Guagliardi, A. & Niccolai, N. (2008). NMR studies on the surface accessibility of the archaeal protein Sso7d by using TEMPOL and Gd(III)(DTPA-BMA) as paramagnetic probes. Biophys. Chem. 137, 71-75.

PDF

11)

Venditti, V., Niccolai, N. & Butcher, S.E. (2008). Measuring the surface accessibility of RNA with the small paramagnetic molecule TEMPOL. Nucl. Acids Res., 36, e20.

PDF

10)

Staple, D.W., Venditti, V., Niccolai, N., Elson-Schwab, L., Tor, Y. & Butcher, S.E. (2008). Structure of the HIV-1 frameshift site RNA in complex with the novel small molecule guanidinoneomycin B. ChemBioChem. 9, 93-102.

PDF

9)

Summa, D., Spiga, O., Bernini, A., Venditti, V., Priora, R., Frosali, S., Margaritis, A., Di Giuseppe, D., Niccolai, N. & Di Simplicio, P. (2007). Protein-Thiol substitution or protein dethiolation by SH/SS exchange reactions: the albumin model. Proteins 69, 369-378.

PDF

8)

Venditti, V., Bernini, A., De Simone, A., Spiga, O., Prischi, F. & Niccolai, N. (2007) MD and NMR studies of α-bungarotoxin surface accessibility. Biochem. Biophys. Res. Commun. 356, 114-117.

PDF

7)

Sashital, D.G., Venditti, V., Angers, C., Cornilescu, G. & Butcher, S.E. (2007). Structure and thermodynamics of a conserved U2 snRNA domain from yeast and human. RNA 13, 328-338.

PDF

6)

Spiga, O., Padula, M.G., Scarselli, M., Ciutti, A., Bernini, A., Venditti, V., Prischi, F., Falciani, C., Lozzi, L., Bracci, L., Valensin, P.E., Caudai, C. & Niccolai, N. (2006). Structurally driven selection of human hepatitis C virus mimotopes. Antivir. Ther. 11, 917-922.

PDF

5)

Bernini, A., Spiga, O., Venditti, V., Prischi, F., Bracci, L., Tong, A.P., Wong, W.T. & Niccolai. N. (2006). NMR studies of lysozyme surface accessibility by using different paramagnetic relaxation probes. J. Am. Chem. Soc. 128, 9290-9291.

PDF

4)

Bernini, A., Spiga, O., Ciutti, A., Venditti, V., Prischi, F., Governatori, M., Bracci, L., Lelli, B., Pileri, S., Botta, M., Barge, A., Laschi, F. & Niccolai, N. (2006). NMR studies of BPTI aggregation by using paramagnetic relaxation reagents. Biochim. Biophys. Acta. 1764, 856-862.

PDF

3)

Bernini, A., Spiga, O., Venditti, V., Prischi, F., Bracci, L., Huang, J., Tanner, J.A. & Niccolai, N. (2006). Tertiary structure prediction of SARS coronavirus helicase. Biochem. Biophys. Res. Commun. 343, 1101-1104.

PDF

2)

Varrazzo, D., Bernini, A., Spiga, O., Ciutti, A., Chiellini, S., Venditti, V., Bracci, L. & Niccolai, N. (2005). Three-dimensional computation of atom depth in complex molecular structures. Bioinformatics 12, 2856-2860.

PDF

1)

Bernini, A., Spiga, O., Ciutti, A., Chiellini, S., Menciassi, N., Venditti, V. & Niccolai, N. (2004). On the dynamics of water molecules at the protein solute interfaces. Homeopathy 93, 199-202.

PDF