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Fundamental and Computational Sciences Directorate

Staff information

Andrew Lipton

Environmental Dynamics & Simulations
Chemist
Pacific Northwest National Laboratory
PO Box 999
MSIN: K8-98
Richland, WA 99352

PNNL Publications

2017

  • Vogelsberg C.S., F.J. Uribe-Romo, A.S. Lipton, S. Yang, K.N. Houk, S.E. Brown, and M.A. Garcia-Garibay. 2017. "Ultrafast rotation in an amphidynamic crystalline metal organic framework." Proceedings of the National Academy of Sciences of the United States of America 114, no. 52:13613-13618. PNNL-SA-125469. doi:10.1073/pnas.1708817115
  • Weaver J.L., C.Z. Soderquist, N.M. Washton, A.S. Lipton, P.L. Gassman, W.W. Lukens, and A.A. Kruger, et al. 2017. "Chemical Trends in Solid Alkali Pertechnetates." Inorganic Chemistry 56, no. 5:2533-2544. PNNL-SA-121324. doi:10.1021/acs.inorgchem.6b02694
  • Xu J., M. Blaakmeer, A.S. Lipton, T.M. Mcdonald, M. Liu, B. Smit, and J.R. Long, et al. 2017. "Uncovering the Local Magnesium Environment in the Metal-Organic Framework Mg2(dobpdc) Using 25Mg NMR Spectroscopy." Journal of Physical Chemistry C 121, no. 36:19938-19945. PNNL-SA-128407. doi:10.1021/acs.jpcc.7b07809

2015

  • Dithmer L., A.S. Lipton, K. Reitzel, T.E. Warner, D. Lundberg, and U. Nielsen. 2015. "Characterization of phosphate sequestration by a lanthanum modified bentonite clay: A solid- state NMR, EXAFS and PXRD study." Environmental Science & Technology 49, no. 7:4559-4566. PNNL-SA-107380. doi:10.1021/es506182s
  • Pushparaj S., C. Forano, V. Prevot, A.S. Lipton, G. Rees, J.V. Hanna, and U. Nielsen. 2015. "How the method of synthesis governs the local and global structure of zinc aluminum layered double hydroxides." Journal of Physical Chemistry C 119, no. 49:27695-27707. PNNL-SA-113148. doi:10.1021/acs.jpcc.5b09490
  • Vugmeyster L., D. Ostrovsky, T. Villafranca, J. Sharp, W. Xu, A.S. Lipton, and G. Hoatson, et al. 2015. "Dynamics of Hydrophobic Core Phenylalanine Residues Probed by Solid-State Deuteron NMR." Journal of Physical Chemistry B 119, no. 47:14892-14904. PNNL-SA-112902. doi:10.1021/acs.jpcb.5b09299

2014

  • Petersen L.B., A.S. Lipton, V. Zorin, and U. Nielsen. 2014. "Local environment and composition of magnesium gallium layered double hydroxides determined from solid-state 1H and 71Ga NMR spectroscopy." Journal of Solid State Chemistry 219. PNNL-SA-100729. doi:10.1016/j.jssc.2014.07.023

2013

  • Han Y., G. Hou, C.L. Suiter, J. Ahn, I.L. Byeon, A.S. Lipton, and S.D. Burton, et al. 2013. "Magic Angle Spinning NMR Reveals Sequence-Dependent Structural Plasticity, Dynamics, and the Spacer Peptide 1 Conformation in HIV-1 Capsid Protein Assemblies." Journal of the American Chemical Society 135, no. 47:17793-17803. PNNL-SA-95705. doi:10.1021/ja406907h
  • Kwak J., J.H. Lee, S.D. Burton, A.S. Lipton, C.H. Peden, and J. Szanyi. 2013. "A common intermediate for N2 formation in enzymes and zeolites: side-on Cu-nitrosyl complexes." Angewandte Chemie International Edition 52, no. 38:9985-9989. PNNL-SA-96945. doi:10.1002/anie.201303498
  • McCloy J.S., B.J. Riley, A.S. Lipton, C.F. Windisch, N.M. Washton, M.J. Olszta, and C.P. Rodriguez. 2013. "Structure and Chemistry in Halide Lead-Tellurite Glasses." Journal of Physical Chemistry C 117, no. 7:3456-3466. PNNL-SA-91103. doi:10.1021/jp310820t
  • Mueller K.T., M. Pruski, N.M. Washton, and A.S. Lipton. 2013. Science Drivers and Technical Challenges for Advanced Magnetic Resonance. PNNL-22294. Richland, WA: Pacific Northwest National Laboratory.
  • Vugmeyster L., D. Ostrovsky, and A.S. Lipton. 2013. "Origin of Abrupt Rise in Deuteron NMR Longitudinal Relaxation Times of Protein Methyl Groups Below 90 K." Journal of Physical Chemistry B 117, no. 20:6129-6137. PNNL-SA-94691. doi:10.1021/jp4021596

2011

  • Comellas Canal G., L.R. Lemkau, A.J. Nieuwkoop, K.D. Kloepper, D.T. Ladror, R. Ebisu, and W.S. Woods, et al. 2011. "Structured Regions of Alpha-synuclein Fibrils Include the Early Onset Parkinson's Disease Mutation Sites." Journal of Molecular Biology 411, no. 4:881-895. PNNL-SA-77470. doi:10.1016/j.jmb.2011.06.026
  • Koch R., A.S. Lipton, S. Filipek, and V.M. Renugopalakrishnan. 2011. "Arginine Interactions with Anatase TiO2 (100) Surface and the Perturbation of 49Ti NMR Chemical Shifts - A DFT Investigation: Relevance to Renu-Seeram Bio Solar Cell." Journal of Molecular Modeling 17, no. 6:1467-1472. PNNL-SA-69688. doi:10.1007/s00894-010-0853-y

2010

  • Davis M.C., W.J. Brouwer, A.S. Lipton, Z. Gan, and K.T. Mueller. 2010. "Characterization of cation environments in polycrystalline forsterite by Mg-25 MAS, MQMAS, and QCPMG NMR." The American Mineralogist 95, no. 11-12:1601-1607. PNNL-SA-75288. doi:10.2138/am.2010.3403
  • Ellis P.D., J.A. Sears, P. Yang, M. Dupuis, T. Boron, V. Pecoraro, and T. Stich, et al. 2010. "Solid-State 55Mn NMR Spectroscopy of bis(µ-oxo)dimanganese(IV) [Mn2O2(salpn)2], a Model for the Oxygen Evolving Complex in Photosystem II." Journal of the American Chemical Society 132, no. 47:16727-16729. PNNL-SA-72469. doi:10.1021/ja1054252
  • Sperling L.J., A.J. Nieuwkoop, A.S. Lipton, D.A. Berthold, and C.M. Rienstra. 2010. "High Resolution NMR Spectroscopy of Nanocrystalline Proteins at Ultra-High Magnetic Field." Journal of Biomolecular NMR 46, no. 2:149-155. PNNL-SA-65253. doi:10.1007/s10858-009-9389-9
  • Vugmeyster L., D. Ostrovsky, J.J. Ford, and A.S. Lipton. 2010. "Freezing of Dynamics of a Methyl Group in a Protein Hydrophobic Core at Cryogenic Temperatures by Deuteron NMR Spectroscopy." Journal of the American Chemical Society 132, no. 12:4038-4039. PNNL-SA-69606. doi:10.1021/ja909599k
  • Vugmeyster L., D. Ostrovsky, M. Moses, J.J. Ford, A.S. Lipton, G. Hoatson, and R.L. Vold. 2010. "Comparative Dynamics of Leucine Methyl Groups in FMOC-Leucine and in a Protein Hydrophobic Core Probed by Solid-State Deuteron Nuclear Magnetic Resonance over 7-324 K Temperature Range." Journal of Physical Chemistry B 114, no. 48:15799-15807. PNNL-SA-74768.

2009

  • Davis M.C., W.J. Brouwer, D.J. Wesolowski, L.M. Anovitz, A.S. Lipton, and K.T. Mueller. 2009. "Magnesium Silicate Dissolution Investigated by 29Si MAS, 1H-29Si CP MAS, 25Mg QCPMG, and 1H-25Mg CP QCPMG NMR." Physical Chemistry Chemical Physics. PCCP 11, no. 32:7013-7021. PNNL-SA-65992. doi:10.1039/b907494e
  • Lipton A.S., P.D. Ellis, and T.E. Polenova. 2009. "Quadrupolar Metal Nuclides in Bioinorganic Chemistry: Solid-State NMR Studies." In Encyclopedia of Magnetic Resonance. Hoboken, New Jersey:John Wiley & Sons, Ltd. PNNL-SA-63190.
  • Lipton A.S., R.W. Heck, W.A. De Jong, A.R. Gao, X. Wu, A. Roehrich, and G.S. Harbison, et al. 2009. "Low Temperature 65 Cu NMR Spectroscopy of the Cu+ Site in Azurin." Journal of the American Chemical Society 131, no. 39:13992-13999. PNNL-SA-63130. doi:10.1021/ja901308v
  • Vugmeyster L., D. Ostrovsky, J.J. Ford, S.D. Burton, A.S. Lipton, G. Hoatson, and R.L. Vold. 2009. "Probing the Dynamics of a Protein Hydrophobic Core by Deutron Solid-State Nuclear Magnetic Resonance Spectroscopy." Journal of the American Chemical Society 131, no. 38:13651-13658. PNNL-SA-66195. doi:10.1021/ja902977u

2008

  • Bouchard L.S., A.O. Sushkov, D. Budker, J. Ford, and A.S. Lipton. 2008. "Nuclear-spin relaxation of 2°7Pb in ferroelectric powders." Physical Review. A. 77, no. 2:Art. No. 022102. PNNL-SA-58084. doi:10.1103/PhysRevA.77.022102
  • Bowmaker G.A., J.V. Hanna, F. Hahn, A.S. Lipton, C.E. Oldham, C.E. Oldham, and B.W. Skelton, et al. 2008. "Structural and spectroscopic studies of some copper(I) halide tert-butyl isocyanide adducts." Journal of the Chemical Society. Dalton Transactions 2008, no. 13:1710-1720. PNWD-SA-8126. doi:10.1039/b712815k
  • Cho H.M., W.J. Shaw, V.M. Parvanov, G.K. Schenter, A.J. Karkamkar, N.J. Hess, and C.J. Mundy, et al. 2008. "Molecular Structure and Dynamics in the Low Temperature (Orthorhombic) Phase of NH3BH3." Journal of Physical Chemistry A 112, no. 18:4277-4283. PNNL-SA-58394.
  • Lipton A.S., M.M. Morlok, G. Parkin, and P.D. Ellis. 2008. "67Zn Solid-State NMR Spectroscopy of {[TpBut,Me]Zn(OH2)}[HOB(C6F5)3]. The Importance of the Anion [HOB(C6F5)3]-." Inorganic Chemistry 47, no. 12:5184-5189. PNWD-SA-8056. doi:10.1021/ic800009b
  • Lipton A.S., R.W. Heck, G.R. Staeheli, M. Valiev, W.A. De Jong, and P.D. Ellis. 2008. "A QM/MM Approach to Interpreting Zn-67 Solid-State NMR data in Zinc Proteins." Journal of the American Chemical Society 130, no. 19:6224-6230. PNWD-SA-8060.
  • Lipton A.S., R.W. Heck, M. Hernick, C.A. Fierke, and P.D. Ellis. 2008. "Residue Ionization in LpxC Directly Observed by 67Zn NMR Spectroscopy." Journal of the American Chemical Society 130, no. 38:12671-12679. PNWD-SA-8123. doi:10.1021/ja801776c
  • Lipton A.S., R.W. Heck, S.V. Primak, D.R. McNeill, D.M. Wilson Iii, and P.D. Ellis. 2008. "Characterization of Mg2? Binding to the DNA Repair Protein Apurinic/Apyrimidic Endonuclease 1 via Solid-State 25Mg NMR Spectroscopy." Journal of the American Chemical Society 130, no. 29:9332-9341. PNWD-SA-7908. doi:10.1021/ja0776881

2007

  • Ellis P.D., and A.S. Lipton. 2007. "Low Temperature Solid-State NMR Spectroscopy. A Strategy for the Direct Observation of Quadrupolar Nuclides of Biological Interest." In Annual Reports on NMR Spectroscopy, edited by G.A. Webb. 1-38. New York:Elsevier. PNWD-SA-6612.
  • Lipton A.S., and P.D. Ellis. 2007. "Modeling the Metal Center of Cys4 Zinc Proteins." Journal of the American Chemical Society 129, no. 29:9192-9200. PNWD-SA-7734. doi:10.1021/ja071430t

2006

  • Bowers G.M., A.S. Lipton, and K.T. Mueller. 2006. "High-field QCPMG NMR of Strontium Nuclei in Natural Minerals." Solid State Nuclear Magnetic Resonance 29, no. 1-3:95-103. PNNL-SA-46703.
  • Larsen F.H., I.E. Farnan, and A.S. Lipton. 2006. "Separation of 47Ti and 49Ti Solid-State NMR Lineshapes by Static QCPMG Experiments at Multiple Fields." Journal of Magnetic Resonance 178, no. 2:228-236. PNNL-SA-46388.

2004

  • Lipton A.S., R.W. Heck, and P.D. Ellis. 2004. "Zinc Solid-State NMR Spectroscopy of Human Carbonic Anhydrase: Implications for the Enzymatic Mechanism." Journal of the American Chemical Society 126, no. 14:4735-4739. PNWD-SA-6180.
  • Lipton A.S., R.W. Heck, J.A. Sears, and P.D. Ellis. 2004. "Low Temperature Solid-State NMR Experiments of Half-Integer Quadrupolar Nuclides: Caveats and Data Analysis." Journal of Magnetic Resonance 168. PNWD-SA-6205.

2003

  • Lipton A.S., C. Bergquist, G. Parkin, and P.D. Ellis. 2003. "Solid-state Zn-67 NMR Spectroscopic Studies and ab initio Molecular Orbital Calculations on a Synthetic Analogue of Carbonic Anhydrase." Journal of the American Chemical Society 125, no. 13:3768-3772. PNNL-SA-37468.

2002

  • Lipton A.S., M.D. Smith, R.D. Adams, and P.D. Ellis. 2002. "Zn-67 Solid-State and Single-Crystal NMR Spectroscopy and X-ray Crystal Structure of Zinc Formate Dihydrate." Journal of the American Chemical Society 124, no. 3:410-414. PNWD-SA-5454.
  • Lipton A.S., T. Wright, M.K. Bowman, D.L. Reger, and P.D. Ellis. 2002. "Solid State 67Zn NMR Spectroscopy in Bioinorganic Chemistry. Spectra of 4-and 6-Coordinate Zinc Pyrazolylborate Complexes Obtained by Management of Proton Relaxation Rates with a Paramagnetic Dopant." Journal of the American Chemical Society .124, no. 20:5850-5860. PNWD-SA-5585.

2001

  • Bowmaker G.A., J.V. Hanna, C.E. Rickard, C.E. Rickard, and A.S. Lipton. 2001. "Crystal Structures and Vibrational and Solid-State (CPMAS) NMR Spectroscopy of Some Bis(triphenylphosphine)silver(I) Sulfate, Selenate and Phosphate Systems." Journal of the Chemical Society. Dalton Transactions. PNNL-SA-33322.
  • Lipton A.S., G.W. Buchko, J.A. Sears, M.A. Kennedy, and P.D. Ellis. 2001. "Zn-67 Solid-State NMR Spectroscopy of the Minimal DNA Binding Domain of Human Nucleotide Excision Repair Protein XPA." Journal of the American Chemical Society 123, no. 5:992-993. PNWD-SA-5156.
  • Lipton A.S., J.A. Sears, and P.D. Ellis. 2001. "A General Strategy for the NMR Observation of Half -Integer Quadrupolar Nuclei in Dilute Environments." Journal of Magnetic Resonance 151, no. 1:48-59. PNWD-SA-5154.
  • Lipton A.S., M.D. Smith, R.D. Adams, and P.D. Ellis. 2001. "67Zn Solid-State and Single-Crystal NMR Spectroscopy and X-ray Crystal Structure of Zinc Formate Dihydrate." Journal of the American Chemical Society 124, no. 3:410-414. PNWD-SA-5442.

1999

  • Jacobs D.M., A.S. Lipton, N.G. Isern, G.W. Daughdrill, D.F. Lowry, X. Gomes, and M.S. Wold. 1999. "Human Replication Protein A: Global Fold of the N-terminal RPA-70 Domain Reveals a Basic Cleft and Flexible C-terminal Linker." Journal of Biomolecular NMR 14, no. 1999:321-331. PNNL-SA-29827.
  • Larsen F.H., A.S. Lipton, H.J. Jakobsen, N.C. Nielsen, and P.D. Ellis. 1999. "67Zn QCPMG Solid-State NMR Studies of Zinc Complexes as Models for Metalloproteins." Journal of the American Chemical Society 121, no. 15:3783-3784. PNNL-SA-30536.

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