Dorothee Kern - Principal Investigator

Professor of Biochemistry
HHMI Investigator

Volen 444
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2354
dkern (at) scripps.edu





Education
  • 1988 - BSc Biochemistry, Martin-Luther University of Halle, Germany
  • 1989 - MSc Biochemistry, Martin-Luther University of Halle, Germany
  • 1994 - PhD Biochemistry, Martin-Luther University of Halle, Germany
  • 1998 - Postdoc Structural Biology, Dept. of Chemistry, University of California, Berkeley & Structural Biology Division, Lawrence Berkeley National Laboratory

Motions are the basis for the function of biological macromolecules. Whereas for many enzymes the structures have been solved, very little is known about dynamic processes, which trigger catalysis. Our main goal is to characterize these motions in enzymes to provide a better understanding of the atomic events in enzyme catalysis as a function of time. We use NMR as a primary tool because it is an excellent method to measure dynamic processes ranging from picoseconds to days. We complement our experiments by computational techniques, namely, molecular dynamics simulations, which provide atomistic insight into the dynamics of macromolecules. Our aim is to reveal the physical mechanism of transitions by combining experimental to computational methods. Click here for more details about our current research and/or read our published work.

Ricardo Pádua
Postdoctoral Fellow
Joined the lab in: 2015

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
rpadua (at) scripps.edu




Education
  • 2008 - BSc Pharmacy and Biochemistry, Universidade de São Paulo, Ribeirão Preto, Brazil
  • 2014 - PhD in Sciences, Faculdade de Ciências Farmacêuticas de Ribeirão Preto Universidade de São Paulo (Brazil) and Queen Mary - University of London (England)
  • 2015 - Postdoctoral Fellow at Laboratory of Protein Crystallography of Ribeirão Preto - FCFRP-USP, Brazil


Publications

From the Kern Lab:

  • Pitsawong W, Pádua RAP, Grant T, Hoemberger M, Otten R, Bradshaw N, Grigorieff N & Kern D. From primordial clocks to circadian oscillators. Nature 2023

  • Otten R#, Pádua RAP#, Bunzel HA#, Nguyen V, Pitsawong W, Patterson M, Sui S, Perry SL, Cohen AE, Hilvert D & Kern D. How directed evolution reshapes the energy landscape in an enzyme to boost catalysis. Science 2020

  • Pádua RAP#, Sun Y#, Marko I, Pitsawong W, Stiller JB, Otten R & Kern D. Mechanism of Activating Mutations and Allosteric Drug Inhibition of the Phosphatase SHP2. Nat. Commun. 2018

  • Pitsawong W#, Buosi V#, Otten R#, Agafonov RV#, Zorba A, Kern N, Kutter S, Kern G, Pádua RAP, Meniche X & Kern D. Dynamics of Human Protein Kinase Aurora A Linked to Drug Selectivity. eLife 2018


Other:

  • Sartim MA, Pinheiro MP, Pádua RAP, Sampaio SV & Nonato MC. Structural and Binding Studies of a C-type Galactose-Binding Lectin from Bothrops jararacussu Snake Venom. Toxicon 2017

  • Pádua RAP, Kia AM, Costa-Filho AJ, Wilkinson SR & Nonato MC. Characterisation of the Fumarate Hydratase Repertoire in Trypanosoma cruzi. Int. J. Biol. Macromol. 2017

  • Pádua RAP, Tomaleri GP, Reis RAG, David JS, Silva V, Pinheiro MP & Nonato MC. ThermoFMN - a Thermofluor Assay Developed for Ligand-Screening as an Alternative Strategy for Drug Discovery. J. Braz. Chem. Soc. 2014

  • Pádua RAP & Nonato MC. Cloning, Expression, Purification, Crystallization and Preliminary X-ray Diffraction Analysis of Recombinant Human Fumarase. Acta Crystallogr. F. Struct. Biol. Commun. 2014


Hannes Ludewig
Postdoctoral Fellow
Joined the lab in: 2020

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
hludewig (at) scripps.edu




Education
  • 2012 - B.Sc. Biochemistry, University of Bayreuth, Germany
  • 2014 - M.Sc. Biochemistry & Molecular Biology, University of Bayreuth, Germany
  • 2020 - Ph.D. Chemistry, Centre for Doctoral Training in Critical Resource Catalysis, School of Chemistry, University of St Andrews, United Kingdom (Scotland)


Publications

From the Kern Lab:

  • Stadnicki EJ, Ludewig H, Ramasamy PK, Wang X, Qiao Y, Kern D & Bradshaw N. Dual-Action Kinase Inhibitors Control p38α MAP Kinase Threonine Dephosphorylation. bioRxiv 2024

  • Kim C, Ludewig H, Hadzipasic A, Kutter S, Nguyen V & Kern D. A biophysical framework for double-drugging kinases. Proc. Natl. Acad. Sci. US 2023


Other:

  • Ludewig H, Molyneux S, Ferrinho S, Guo K, Lynch R, Gkotsi DS & Goss RJMG. Halogenases: structures and functions. Curr. Opin. Struct. Biol. 2020

  • Gkotsi DS, Ludewig H, Sharma SV, Connolly JA, Dhaliwal J, Wang Y, Unsworth WP, Taylor RJK, McLachlan MWM, Shanahan S, Naismith JH & Goss RJM. A marine viral halogenase that iodinates divers substrates. Nat. Chem. 2019

  • Ludewig H, Czekster CM, Oueis E, Munday ES, Arshad M, Synowsky SA, Bent AF & Naismith JH. Characterization of the Fast and Promiscuous Macrocyclase from Plant PCY1 Enables the Use of Simple Substrates. ACS Chem. Biol. 2018

  • Czekster CM, Ludewig H, McMahon SA & Naismith JH. Characterization of a dual function macrocyclase enables design and use of efficient macrocyclization substrates. Nat. Commun. 2017

  • Oueis E, Adamson C, Mann G, Ludewig H, Redpath P, Migaud M, Westwood NJ & Naismith JH. Derivatisable Cyanobactin Analogues: A Semisynthetic Approach. ChemBioChem 2015

  • Koehnke J, Mann G, Bent AF, Ludewig H, Shirran S, Botting C, Lebl T, Houssen WE, Jaspars M & Naismith JH. Structural analysis of leader peptide binding enables leader-free cyanobactin processing. Nat. Chem. Biol. 2015


Hannah Wayment-Steele
Postdoctoral Fellow
Joined the lab in: 2022

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
hwayment (at) scripps.edu




Education
  • 2015 - B.A. Chemistry & Mathematics, Pomona College, USA
  • 2016 - M.Phil. Chemistry, Cambridge University, UK
  • 2021 - PhD Chemistry, Stanford, USA


Publications

From the Kern Lab:

  • Wayment-Steele HK#, Otten R#, Pitsawong W#, Ojoawo A#, Glaser A, Calderone LA & Kern D. The conformational landscape of fold-switcher KaiB is tuned to the circadian rhythm timescale. bioRxiv 2024

  • Zhang Z, Wayment-Steele HK, Brixi G, Wang H, Dal Peraro M, Kern D & Ovchinnikov S. Protein language models learn evolutionary statistics of interacting sequence motifs. bioRxiv 2024

  • Wayment-Steele HK#, Ojoawo A#, Otten R, Apitz JM, Pitsawong W, Hoemberger M, Ovchinnikov S, Colwell L & Kern D. Predicting multiple conformations via sequence clustering and AlphaFold2. Nature 2023


Other:

  • Wayment-Steele HK, Kladwang W, Strom AI, Becka A, Lee J, Treuille A, Eterna Participants, Das R. RNA secondary structure packages evaluated and improved by high-throughput experiments. bioRxiv 2022

  • Wayment-Steele HK, Kladwang W, Watkins AM, Kim DS, Tunguz B, … Das R. Deep learning models for predicting RNA degradation via dual crowdsourcing. Arxiv 2022

  • Leppek K, Byeon GW, Kladwang W, Wayment-Steele HK, Kerr CH, … Barna M & Das R. Combinatorial optimization of mRNA structure, stability, and translation for RNA-based therapeutics. Nature Communications 2021

  • Wayment-Steele HK, Kim DS, Choe CA, Nicol JJ, Wellington-Oguri R, Sperberg RAP, Huang P, Eterna Participants & Das R. Theoretical basis for stabilizing messenger RNA through secondary structure design. Nucleic Acids Research 2021

  • Wayment-Steele HK, Wu M, Gotrik M & Das R. Evaluating riboswitch optimality. Methods in Enzymology 2019

  • Kostrz D, Wayment-Steele HK, Wang JL, Follenfant M, Pande VS, Strick TR & Gosse C. A modular DNA scaffold to study protein–protein interactions at single-molecule resolution. Nature Nanotechnology 2019

  • Wayment-Steele HK & Pande VS. Variational encoding of protein dynamics benefits from maximizing latent autocorrelation. The Journal of Chemical Physics 2018

  • Hernandez CX, Wayment-Steele HK, Sultan MM, Husic BE & Pande VS. Variational Encoding of Complex Dynamics. Physical Review E 2018

  • Sultan MM, Wayment-Steele HK & Pande VS. Transferable neural networks for enhanced sampling of protein dynamics. Journal of Chemical Theory and Computation 2018


Adedolapo Ojoawo
Postdoctoral Fellow
Joined the lab in: 2022

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
aojoawo (at) scripps.edu




Education
  • 2015 - B.Sc. Chemistry, Saint Catherine University, USA
  • 2020 - Ph.D. Biochemistry, University of Illinois at Urbana Champaign, USA
  • 2022 - Postdoctoral fellow at Saint Jude Children's Hospital Structural Biology Department, USA


Publications

From the Kern Lab:

  • Wayment-Steele HK#, Otten R#, Pitsawong W#, Ojoawo A#, Glaser A, Calderone LA & Kern D. The conformational landscape of fold-switcher KaiB is tuned to the circadian rhythm timescale. bioRxiv 2024

  • Wayment-Steele HK#, Ojoawo A#, Otten R, Apitz JM, Pitsawong W, Hoemberger M, Ovchinnikov S, Colwell L & Kern D. Predicting multiple conformations via sequence clustering and AlphaFold2. Nature 2023


Other:

  • Sekar G, Ojoawo A & Moldoveanu T. Protein–protein and protein–lipid interactions of pore-forming BCL-2 family proteins in apoptosis initiation. Biochem Soc Trans 2022

  • Ojoawo A & Moldoveanu T. A killer metamorphosis: catching BAK in action at the membrane. The EMBO Journal 2021

  • McClain SM, Ojoawo A, Lin W, Rienstra MC & Murphy CJ. Interaction of Alpha-Synuclein and Its Mutants with Rigid Lipid Vesicle Mimics of Varying Surface Curvature. ACS Nano 2020


Andrew Glaser

Andrew Glaser
Graduate Student
Joined the lab in: 2019

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
aglaser (at) scripps.edu




Education
  • 2016 - BSc Biochemistry, Union College, Schenectady, NY, USA


Publications

From the Kern Lab:

  • Wayment-Steele HK#, Otten R#, Pitsawong W#, Ojoawo A#, Glaser A, Calderone LA & Kern D. The conformational landscape of fold-switcher KaiB is tuned to the circadian rhythm timescale. bioRxiv 2024



MacKenzie Patterson

MacKenzie Patterson
Graduate Student
Joined the lab in: 2019

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
mpatterson (at) scripps.edu




Education
  • 2018 - BSc Biochemistry, University of Massachusetts Boston, Boston, MA, USA


Publications

From the Kern Lab:

  • Otten R#, Pádua RAP#, Bunzel HA#, Nguyen V, Pitsawong W, Patterson M, Sui S, Perry SL, Cohen AE, Hilvert D & Kern D. How directed evolution reshapes the energy landscape in an enzyme to boost catalysis. Science 2020


Other:

  • Ramasamy PK, Matos JO, Black BY, Ellenburg WH, Chen J, Patterson M, Gehtman J, Theoblad DL, Krauss IJ & Oprian DD. Crystal Structure of Caryolan-1-ol Synthase, a Sesquiterpene Synthase Catalyzing an Initial Anti-Markovnikov Cyclization Reaction. bioRxiv 2024

  • Webb J, Lieu JJM, Gnann AD, Patterson M, Paul S, Forés M, Jiménez G, Veraksa A & Downling DP. Molecular Basis of DNA recognition by the HMG=box-C1 module of Capicua. bioRxiv 2022

  • Matos JO, Ramasamy PK, Ma AC, Patterson M, Krauss IJ & Oprian DD. Mechanism Underlying Anti-Markovnikov Addition in the Reaction of Pentalenene Synthase. Biochemistry 2020


Christiana Ntangka

Christiana Ntangka
Graduate Student
Joined the lab in: 2021

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
cntangka (at) scripps.edu




Education
  • 2020 - BS in Biochemistry, Old Dominion University, Norfolk, VA, USA


Publications

  • Bowitch A, Sahoo A, Clark AM, Ntangka C, Raut KK, Gollnick I, Yu MC, Pascal SM, Walker SE & Ferkey DM. Methylation of the D2 dopamine receptor affects binding with the human regulatory proteins Par-4 and Calmodulin. MicroPubl Biol. 2021


Lufan Xiao

Lufan Xiao
Graduate Student
Joined the lab in: 2022

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
lxiao (at) scripps.edu




Education
  • 2021 - BS Biochemistry, University of California San Diego, USA
  • 2023 - MS Biochemistry, Brandeis University, USA


Camille Sullivan

Camille Sullivan
Graduate Student
Joined the lab in: 2022

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
camillesullivan (at) brandeis.edu




Education
  • 2018 - BA Molecular Biology, Princeton University, USA


Bo Kim

Bo Kim
Graduate Student
Joined the lab in: 2024

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
bokyungk (at) scripps.edu




Education
  • 2020 - BS Bioscience & Biotechnology, Hankuk University of Foreign Studies, Yongin, Republic of Korea
  • 2022 - MS Biochemistry, Korea University, Seoul, Republic of Korea


Publications

  • Ames A, Seman M, Larkin A, Raiymbek G, Chen Z, Levashkevich A, Kim B, Biteen JS & Ragunathan K. Epigenetic memory is governed by an effector recruitment specificity toggle in Heterochromatin Protein I. bioRxiv 2024


Aedan Using

Aedan Using
Undergraduate Student
Joined the lab in: 2023

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
aedanusing (at) brandeis.edu


Gilbert Otoo

Gilbert Otoo
Undergraduate Student
Joined the lab in: 2024

Volen 443
Department of Biochemistry, MS 009
Brandeis University
415 South Street
Waltham, MA 02453-2728

tel: 781 736 2326
gotoo (at) brandeis.edu