Simultaneous Quantification and Identification of Individual Chemicals in Metabolite Mixtures by Two-Dimensional Extrapolated Time-Zero (1)H−(13)C HSQC (HSQC(0))

por Hu, Kaifeng, Westler, William M., Markley, John L.
Publicado 2011

Two-dimensional concurrent HMQC-COSY as an approach for small molecule chemical shift assignment and compound identification

por Hu, Kaifeng, Westler, William M., Markley, John L.
Publicado 2011

Correction to Simultaneous Quantification and Identification of Individual Chemicals in Metabolite Mixtures by Two-Dimensional Extrapolated Time-Zero (1)H–(13)C HSQC (HSQC(0))

por Hu, Kaifeng, Westler, William M., Markley, John L.
Publicado 2012

NMR Investigations of the Rieske Protein from Thermus thermophilus Support a Coupled Proton and Electron Transfer Mechanism

por Hsueh, Kuang-Lung, Westler, William M., Markley, John L.
Publicado 2010

PONDEROSA, an automated 3D-NOESY peak picking program, enables automated protein structure determination

por Lee, Woonghee, Kim, Jin Hae, Westler, William M., Markley, John L.
Publicado 2011

Unique identifiers for small molecules enable rigorous labeling of their atoms

por Dashti, Hesam, Westler, William M., Markley, John L., Eghbalnia, Hamid R.
Publicado 2017

PINE-SPARKY: graphical interface for evaluating automated probabilistic peak assignments in protein NMR spectroscopy

por Lee, Woonghee, Westler, William M., Bahrami, Arash, Eghbalnia, Hamid R., Markley, John L.
Publicado 2009

Hyperfine-Shifted (13)C Resonance Assignments in an Iron−Sulfur Protein with Quantum Chemical Verification: Aliphatic C−H···S 3-Center−4-Electron Interactions

por Westler, William M., Lin, I-Jin, Perczel, András, Weinhold, Frank, Markley, John L.
Publicado 2011

NMRmix: A Tool for the Optimization of Compound Mixtures in 1D (1)H NMR Ligand Affinity Screens

por Stark, Jaime L., Eghbalnia, Hamid R., Lee, Woonghee, Westler, William M., Markley, John L.
Publicado 2016

Automated evaluation of consistency within the PubChem Compound database

por Dashti, Hesam, Wedell, Jonathan R., Westler, William M., Markley, John L., Eghbalnia, Hamid R.
Publicado 2019

NMRbot: Python scripts enable high-throughput data collection on current Bruker BioSpin NMR spectrometers

por Clos, Lawrence J., Jofre, M. Fransisca, Ellinger, James J., Westler, William M., Markley, John L.
Publicado 2013

Hyperfine-Shifted (13)C and (15)N NMR Signals from Clostridium pasteurianum Rubredoxin: Extensive Assignments and Quantum Chemical Verification

por Lin, I-Jin, Xia, Bin, King, David S., Machonkin, Timothy E., Westler, William M., Markley, John L.
Publicado 2009

NMR Method for Measuring Carbon-13 Isotopic Enrichment of Metabolites in Complex Solutions

por Lewis, Ian A., Karsten, Ryan H., Norton, Mark E., Tonelli, Marco, Westler, William M., Markley, John L.
Publicado 2010

Structural Characterization of Hsp12, the Heat Shock Protein from Saccharomyces cerevisiae, in Aqueous Solution Where It Is Intrinsically Disordered and in Detergent Micelles Where...

por Singarapu, Kiran K., Tonelli, Marco, Chow, Darius C., Frederick, Ronnie O., Westler, William M., Markley, John L.
Publicado 2011

An Amphipathic α-Helix Controls Multiple Roles of Brome Mosaic Virus Protein 1a in RNA Replication Complex Assembly and Function

por Liu, Ling, Westler, William M., den Boon, Johan A., Wang, Xiaofeng, Diaz, Arturo, Steinberg, H. Adam, Ahlquist, Paul
Publicado 2009

Accurate Structure and Dynamics of the Metal-Site of Paramagnetic Metalloproteins from NMR Parameters Using Natural Bond Orbitals

por Hansen, D. Flemming, Westler, William M., Kunze, Micha B. A., Markley, John L., Weinhold, Frank, Led, Jens J.
Publicado 2012

Solution Structural Studies of GTP:Adenosylcobinamide-Phosphateguanylyl Transferase (CobY) from Methanocaldococcus jannaschii

por Singarapu, Kiran K., Otte, Michele M., Tonelli, Marco, Westler, William M., Escalante-Semerena, Jorge C., Markley, John L.
Publicado 2015

The Complex Energy Landscape of the Protein IscU

por Bothe, Jameson R., Tonelli, Marco, Ali, Ibrahim K., Dai, Ziqi, Frederick, Ronnie O., Westler, William M., Markley, John L.
Publicado 2015

Probabilistic identification of saccharide moieties in biomolecules and their protein complexes

por Dashti, Hesam, Westler, William M., Wedell, Jonathan R., Demler, Olga V., Eghbalnia, Hamid R., Markley, John L., Mora, Samia
Publicado 2020

Conservation and Divergence in the Candida Species Biofilm Matrix Mannan-Glucan Complex Structure, Function, and Genetic Control

por Dominguez, Eddie, Zarnowski, Robert, Sanchez, Hiram, Covelli, Antonio S., Westler, William M., Azadi, Parastoo, Nett, Jeniel, Mitchell, Aaron P., Andes, David R.
Publicado 2018