A. Orville

发表

High-throughput in situ experimental phasing

G. Evans, J. Lawrence, J. Orlans, 2020, Acta crystallographica. Section D, Structural biology.

F. von Delft, J. Grimes, K. McAuley, 2018, Acta crystallographica. Section D, Structural biology.

An acoustic on-chip goniometer for room temperature macromolecular crystallography.

P. Docker, P. Topham, R. Morris, 2017, Lab on a chip.

Acoustic methods for high-throughput protein crystal mounting at next-generation macromolecular crystallographic beamlines.

Alexei S Soares, Anthony Kuczewski, Marc Allaire, 2013, Journal of synchrotron radiation.

Acoustically mounted microcrystals yield high-resolution X-ray structures.

M. Allaire, A. Héroux, A. Orville, 2011, Biochemistry.

Hitting the target: fragment screening with acoustic in situ co-crystallization of proteins plus fragment libraries on pin-mounted data-collection micromeshes

R. Sweet, M. Allaire, A. Orville, 2014, Acta crystallographica. Section D, Biological crystallography.

A Linear Relationship between Crystal Size and Fragment Binding Time Observed Crystallographically: Implications for Fragment Library Screening Using Acoustic Droplet Ejection

R. Sweet, M. Allaire, A. Orville, 2014, PloS one.

Recent results in time resolved serial femtosecond crystallography at XFELs.

A. Orville, 2020, Current opinion in structural biology.

Spectroscopic and electronic structure study of the enzyme-substrate complex of intradiol dioxygenases: substrate activation by a high-spin ferric non-heme iron site.

Mindy I. Davis, J. Lipscomb, E. Solomon, 2007, Journal of the American Chemical Society.

Resonance Raman studies of the protocatechuate 3,4-dioxygenase from Brevibacterium fuscum.

D. Ohlendorf, L. Que, J. Lipscomb, 1992, Biochemistry.

Protocatechuate 3,4-dioxygenase from Brevibacterium fuscum.

J. W. Whittaker, J. Lipscomb, A. Orville, 1990, Methods in enzymology.

An EXAFS study of the interaction of substrate with the ferric active site of protocatechuate 3,4-dioxygenase.

L. Que, J. Lipscomb, A. Orville, 1990, Biochemistry.

High Resolution XFEL Structure of the Soluble Methane Monooxygenase Hydroxylase Complex with its Regulatory Component at Ambient Temperature in Two Oxidation States.

Jaehyun Park, K. Tono, R. Banerjee, 2020, Journal of the American Chemical Society.

Entering an era of dynamic structural biology…

Allen M. Orville, A. Orville, 2018, BMC Biology.

The XFEL Hub at Diamond: A Bridge between Structural Biologists and Facilities

A. Orville, 2017 .

Spectroscopic studies of isopenicillin N synthase. A mononuclear nonheme Fe2+ oxidase with metal coordination sites for small molecules and substrate.

J. Lipscomb, A. Orville, V. J. Chen, 1989, The Journal of biological chemistry.

Crystal structures and functional studies of T4moD, the toluene 4-monooxygenase catalytic effector protein.

B. Fox, A. Orville, J. Studts, 2005, Biochemistry.

Anaerobic fixed-target serial crystallography

Selina L. S. Storm, A. Ebrahim, S. Carr, 2020, IUCrJ.

Structure of protocatechuate 3,4-dioxygenase from Pseudomonas aeruginosa at 2.15 A resolution.

D. Ohlendorf, J. Lipscomb, A. Orville, 1994, Journal of molecular biology.

X-ray absorption spectroscopic studies of the Fe(II) active site of catechol 2,3-dioxygenase. Implications for the extradiol cleavage mechanism.

M. Miller, L. Que, J. Lipscomb, 1995, Biochemistry.

Electron paramagnetic resonance spectroelectrochemical titration.

A. Orville, M. Stankovich, K. E. Paulsen, 1993, Methods in enzymology.

Crystal structures of intermediates in the nitroalkane oxidase reaction.

P. F. Fitzpatrick, A. Héroux, A. Orville, 2009, Biochemistry.

Role of Glu312 in binding and positioning of the substrate for the hydride transfer reaction in choline oxidase.

O. Quaye, G. Gadda, A. Orville, 2008, Biochemistry.

[17O]Water and nitric oxide binding by protocatechuate 4,5-dioxygenase and catechol 2,3-dioxygenase. Evidence for binding of exogenous ligands to the active site Fe2+ of extradiol dioxygenases.

J. Lipscomb, A. Orville, D. Arciero, 1985, The Journal of biological chemistry.

Mechanistic aspects of dihydroxybenzoate dioxygenases

J. Lipscomb, A. Orville, 1992 .

Variable-temperature variable-field magnetic circular dichroism studies of the Fe(II) active site in metapyrocatechase : implications for the molecular mechanism of extradiol dioxygenases

J. Lipscomb, E. Solomon, A. Orville, 1991 .

New Science Opportunities Enabled by LCLS-II X-ray Lasers

Anton Barty, Sebastian Doniach, Paul D. Adams, 2015 .

Contact angle and active drop transport for time resolved Macromolecular and serial femto-second crystallography

P. Docker, P. Topham, A. Orville, 2017 .

Molecular basis for GTP recognition by light‐activated guanylate cyclase RhGC

R. Owens, A. Orville, I. Moraes, 2019, The FEBS journal.

Redox-controlled structural reorganization and flavin strain within the ribonucleotide reductase R2b-NrdI complex monitored by serial femtosecond crystallography

K. Tono, A. Bhowmick, S. Gul, 2022, bioRxiv.

The crystal structure of NAD(P)H oxidase from Lactobacillus sanfranciscensis: insights into the conversion of O2 into two water molecules by the flavoenzyme.

Tracey L. Thaler, A. Bommarius, A. Orville, 2006, Biochemistry.

Crystallographic, spectroscopic, and computational analysis of a flavin C4a-oxygen adduct in choline oxidase.

G. Gadda, A. Orville, Rajeev Prabhakar, 2009, Biochemistry.

Crystallization and preliminary analysis of a water-forming NADH oxidase from Lactobacillus sanfranciscensis.

A. Bommarius, A. Orville, William B. Wellborn, 2004, Acta crystallographica. Section D, Biological crystallography.

Structure of photosystem II and substrate binding at room temperature

Marcin Sikorski, Nicholas K. Sauter, Paul D. Adams, 2016, Nature.

Pico-litre sample introduction and acoustic levitation systems for time resolved protein crystallography experiments at XFELS

D. Stuart, P. Docker, R. Morris, 2017 .

The developments of a Helium Acoustic Levitation Environment for time resolved XFEL experiments

P. Docker, R. Morris, M. Newton, 2018 .

Reducing sample consumption for serial crystallography using acoustic drop ejection

P. Docker, A. Ebrahim, A. Orville, 2019, Journal of synchrotron radiation.

Mass Spectrometric Assays Reveal Discrepancies in Inhibition Profiles for the SARS‐CoV‐2 Papain‐Like Protease

C. Schofield, A. Tumber, P. Lukacik, 2022, ChemMedChem.

Acoustic Injectors for Drop-On-Demand Serial Femtosecond Crystallography.

A. Kuczewski, Diling Zhu, A. Cohen, 2016, Structure.

Escherichia coli methionine aminopeptidase: implications of crystallographic analyses of the native, mutant, and inhibited enzymes for the mechanism of catalysis.

B. Matthews, W. Lowther, D. Rich, 1999, Biochemistry.

Faropenem reacts with serine and metallo-β-lactamases to give multiple products.

A. Lucic, C. Schofield, A. Orville, 2021, European journal of medicinal chemistry.

Redox properties of electron-transfer flavoprotein ubiquinone oxidoreductase as determined by EPR-spectroelectrochemistry.

J. Lipscomb, A. Orville, F. Frerman, 1992, Biochemistry.

The anti-angiogenic agent fumagillin covalently modifies a conserved active-site histidine in the Escherichia coli methionine aminopeptidase.

B. Matthews, W. Lowther, A. Orville, 1998, Proceedings of the National Academy of Sciences of the United States of America.

Quaternary ammonium oxidative demethylation: X-ray crystallographic, resonance Raman, and UV-visible spectroscopic analysis of a Rieske-type demethylase.

Karen N. Allen, Allen M. Orville, A. Orville, 2012, Journal of the American Chemical Society.

Protocatechuate 4,5-dioxygenase from Pseudomonas testosteroni.

J. Lipscomb, A. Orville, D. Arciero, 1990, Methods in enzymology.

Crystallization and preliminary analysis of xenobiotic reductase A and ligand complexes from Pseudomonas putida II-B.

B. Fox, G. Chambliss, A. Orville, 2004, Acta crystallographica. Section D, Biological crystallography.

Single-crystal Raman spectroscopy and X-ray crystallography at beamline X26-C of the NSLS

R. Sweet, A. Orville, J. Skinner, 2010, Journal of synchrotron radiation.

X-ray free-electron laser studies reveal correlated motion during isopenicillin N synthase catalysis

M. Hunter, Y. Joti, K. Tono, 2021, Science Advances.

An on-demand, drop-on-drop method for studying enzyme catalysis by serial crystallography

Selina L. S. Storm, K. Tono, F. Houle, 2021, Nature Communications.

Megahertz serial crystallography

Steffen Hauf, Hans Fangohr, Marcin Sikorski, 2018, Nature Communications.

Drop-on-demand sample delivery for studying biocatalysts in action at X-ray free-electron lasers

Uwe Bergmann, Henrik Lemke, Mengning Liang, 2017, Nature Methods.

Thiolate ligation of the active site Fe2+ of isopenicillin N synthase derives from substrate rather than endogenous cysteine: spectroscopic studies of site-specific Cys----Ser mutated enzymes.

B. Fox, J. Lipscomb, A. Orville, 1992, Biochemistry.

Dynamic Structural Biology Experiments at XFEL or Synchrotron Sources.

A. Orville, P. Aller, 2021, Methods in molecular biology.

Differential quantum tunneling contributions in nitroalkane oxidase catalyzed and the uncatalyzed proton transfer reaction

Jiali Gao, Annie Heroux, Jiali Gao, 2009, Proceedings of the National Academy of Sciences.

Crystal structures of nitroalkane oxidase: insights into the reaction mechanism from a covalent complex of the flavoenzyme trapped during turnover.

A. Orville, A. Nagpal, M. Valley, 2006, Biochemistry.

Untangling the sequence of events during the S2 → S3 transition in photosystem II and implications for the water oxidation mechanism

K. Tono, J. Holton, P. Adams, 2020, Proceedings of the National Academy of Sciences.

Structures of the intermediates of Kok’s photosynthetic water oxidation clock

Nicholas K. Sauter, Paul D. Adams, Sébastien Boutet, 2018, Nature.

Photoreversible interconversion of a phytochrome photosensory module in the crystalline state

Mitchell D. Miller, G. Phillips, M. Hunter, 2019, Proceedings of the National Academy of Sciences.

Macromolecular crystallography beamline X25 at the NSLS

Robert M. Sweet, John M. Skinner, Lonny E. Berman, 2014, Journal of synchrotron radiation.

Synthesis of 17O- or 18O-enriched dihydroxy aromatic compounds.

J. Lipscomb, A. Orville, M. Harpel, 1990, Methods in Enzymology.

Redox-controlled reorganization and flavin strain within the ribonucleotide reductase R2b–NrdI complex monitored by serial femtosecond crystallography

Ville R. I. Kaila, K. Tono, A. Bhowmick, 2022, eLife.

Acoustic transfer of protein crystals from agarose pedestals to micromeshes for high-throughput screening

R. Sweet, M. Allaire, A. Orville, 2015, Acta crystallographica. Section D, Biological crystallography.

Solvent minimization induces preferential orientation and crystal clustering in serial micro-crystallography on micro-meshes, in situ plates and on a movable crystal conveyor belt

R. Sweet, M. Allaire, A. Orville, 2014, Journal of synchrotron radiation.

Binding of isotopically labeled substrates, inhibitors, and cyanide by protocatechuate 3,4-dioxygenase.

J. Lipscomb, A. Orville, 1989, The Journal of biological chemistry.

Crystallization and preliminary analysis of xenobiotic reductase B from Pseudomonas fluorescens I-C.

B. Fox, G. Chambliss, A. Orville, 2004, Acta crystallographica. Section D, Biological crystallography.

PGRP-LB: An Inside View into the Mechanism of the Amidase Reaction

L. Soulère, A. Heddi, J. Orlans, 2021, International journal of molecular sciences.

Mechanistic and structural analyses of the roles of Arg409 and Asp402 in the reaction of the flavoprotein nitroalkane oxidase.

Patrick G. Shaw, A. Orville, M. Valley, 2008, Biochemistry.

Nitroalkane oxidase, a carbanion-forming flavoprotein homologous to acyl-CoA dehydrogenase.

A. Orville, A. Nagpal, M. Valley, 2005, Archives of biochemistry and biophysics.

Biological Crystallography Crystallization and Preliminary Analysis of Active Nitroalkane Oxidase in Three Crystal Forms

A. Orville, A. Nagpal, M. Valley, 2022 .

Structural and kinetic studies on the Ser101Ala variant of choline oxidase: catalysis by compromise.

I. Weber, G. Gadda, A. Orville, 2010, Archives of biochemistry and biophysics.

Entering an era of dynamic structural biology…

A. Orville, 2018, BMC Biology.

R. Sweet, A. Orville, J. Skinner, 2011, Journal of synchrotron radiation.

X-ray radiation induces deprotonation of the bilin chromophore in crystalline D. radiodurans phytochrome.

G. Schatz, R. Vierstra, A. Orville, 2015, Journal of the American Chemical Society.

Structures of the intermediates of Kok’s photosynthetic water oxidation clock

S. Boutet, D. Sokaras, R. Sierra, 2018, Nature.

The adaptability of the ion binding site by the Ag(I)/Cu(I) periplasmic chaperone SilF

J. Hobman, D. Scott, S. Carr, 2023, bioRxiv.

Crystal structures of substrate and substrate analog complexes of protocatechuate 3,4-dioxygenase: endogenous Fe3+ ligand displacement in response to substrate binding.

D. Ohlendorf, J. Lipscomb, A. Orville, 1997, Biochemistry.

Probing the Reaction Mechanism of Protocatechuate 3,4-Dioxygenase with X-Ray Crystallography

D. Ohlendorf, J. Lipscomb, A. Orville, 1998 .

Fundamentally Divergent Strategies for Oxygen Activation by Fe 2+ and Fe 3+ Catecholic Dioxygenases

D. Ohlendorf, J. Lipscomb, A. Orville, 1998 .

Synchrotron X-ray-induced photoreduction of ferric myoglobin nitrite crystals gives the ferrous derivative with retention of the O-bonded nitrite ligand.

A. Orville, G. B. Richter‐Addo, J. Skinner, 2010, Biochemistry.

Crystal structure and resonance Raman studies of protocatechuate 3,4-dioxygenase complexed with 3,4-dihydroxyphenylacetate.

D. Ohlendorf, L. Que, J. Lipscomb, 1997, Biochemistry.

Structures of competitive inhibitor complexes of protocatechuate 3,4-dioxygenase: multiple exogenous ligand binding orientations within the active site.

J D Lipscomb, D. Ohlendorf, J. Lipscomb, 1997, Biochemistry.

A redox switch allows binding of Fe(II) and Fe(III) ions in the cyanobacterial iron binding protein FutA from Prochlorococcus

G. Murshudov, I. Tews, J. Worrall, 2023, bioRxiv.

Spectroscopic and electronic structure studies of protocatechuate 3,4-dioxygenase: nature of tyrosinate-Fe(III) bonds and their contribution to reactivity.

F. Neese, J. Lipscomb, E. Solomon, 2002, Journal of the American Chemical Society.

Crystallographic and spectroscopic snapshots reveal a dehydrogenase in action

L. Huo, A. Orville, B. Andi, 2015, Nature Communications.

Simultaneous binding of nitric oxide and isotopically labeled substrates or inhibitors by reduced protocatechuate 3,4-dioxygenase.

J. Lipscomb, A. Orville, 1993, The Journal of biological chemistry.

Structure of a ribonucleotide reductase R2 protein radical

Ville R. I. Kaila, B. Sjöberg, A. Bhowmick, 2023, Science.

Acoustic methods for high-throughput protein crystal mounting at next-generation macromolecular crystallographic beamlines.

A. Kuczewski, M. Allaire, A. Orville, 2013, Journal of synchrotron radiation.

In Situ Structural Observation of a Substrate- and Peroxide-Bound High-Spin Ferric-Hydroperoxo Intermediate in the P450 Enzyme CYP121.

A. Bhowmick, A. Brewster, A. Orville, 2023, Journal of the American Chemical Society.

Crystallization and preliminary analysis of native and N-terminal truncated isoforms of toluene-4-monooxygenase catalytic effector protein.

B. Fox, A. Orville, J. Studts, 2003, Acta crystallographica. Section D, Biological crystallography.