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

SciPy 1.0: fundamental algorithms for scientific computing in Python

(2020) Pauli Virtanen et al.   NATURE METHODS

Reaction Initiation in Enzyme Crystals by Diffusion of Substrate

(2020) Marius Schmidt   Crystals

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

(2020) Mohamed Ibrahim et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

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

(2020) Vivek Srinivas et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Bicyclic Boronates as Potent Inhibitors of AmpC, the Class C β-Lactamase from Escherichia coli

(2020) Pauline A. Lang et al.   Biomolecules

Recent results in time resolved serial femtosecond crystallography at XFELs

(2020) Allen M Orville   CURRENT OPINION IN STRUCTURAL BIOLOGY

X-Ray Free-Electron Lasers for the Structure and Dynamics of Macromolecules

(2019) Henry N. Chapman   Annual Review of Biochemistry

Time-resolved protein activation by proximal decaging in living systems

(2019) Jie Wang et al.   NATURE

Molecular Basis of Class A β-Lactamase Inhibition by Relebactam

(2019) Catherine L. Tooke et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Liquid application method for time-resolved analyses by serial synchrotron crystallography

(2019) Pedram Mehrabi et al.   NATURE METHODS

Reducing sample consumption for serial crystallography using acoustic drop ejection

(2019) Bradley Davy et al.   JOURNAL OF SYNCHROTRON RADIATION

Photoreversible interconversion of a phytochrome photosensory module in the crystalline state

(2019) E. Sethe Burgie et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Mix-and-inject XFEL crystallography reveals gated conformational dynamics during enzyme catalysis

(2019) Medhanjali Dasgupta et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Enzyme intermediates captured “on the fly” by mix-and-inject serial crystallography

(2018) Jose L. Olmos et al.   BMC BIOLOGY

Entering an era of dynamic structural biology…

(2018) Allen M. Orville   BMC BIOLOGY

DIALS: implementation and evaluation of a new integration package

(2018) Graeme Winter et al.   Acta Crystallographica Section D-Structural Biology

Improving signal strength in serial crystallography with DIALS geometry refinement

(2018) Aaron S. Brewster et al.   Acta Crystallographica Section D-Structural Biology

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

(2018) Jan Kern et al.   NATURE

Real-time crystallographic studies of the adenine riboswitch using an X-ray free-electron laser

(2017) Jason R. Stagno et al.   FEBS Journal

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

(2017) Franklin D Fuller et al.   NATURE METHODS

Capturing an initial intermediate during the P450nor enzymatic reaction using time-resolved XFEL crystallography and caged-substrate

(2017) Takehiko Tosha et al.   Nature Communications

Mix-and-diffuse serial synchrotron crystallography

(2017) Kenneth R. Beyerlein et al.   IUCrJ

Insights into an efficient light-driven hybrid P450 BM3 enzyme from crystallographic, spectroscopic and biochemical studies

(2016) Jessica Spradlin et al.   BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS

Dynamics of internal jets in the merging of two droplets of unequal sizes

(2016) Chenglong Tang et al.   JOURNAL OF FLUID MECHANICS

Structure of photosystem II and substrate binding at room temperature

(2016) Iris D. Young et al.   NATURE

Structural enzymology using X-ray free electron lasers

(2016) Christopher Kupitz et al.   Structural Dynamics

Reduced endogenous Ca2+buffering speeds active zone Ca2+signaling

(2015) Igor Delvendahl et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

A modular and compact portable mini-endstation for high-precision, high-speed fixed target serial crystallography at FEL and synchrotron sources

(2015) Darren A. Sherrell et al.   JOURNAL OF SYNCHROTRON RADIATION

XFEL diffraction: developing processing methods to optimize data quality

(2015) Nicholas K. Sauter   JOURNAL OF SYNCHROTRON RADIATION

ThePDB_REDOserver for macromolecular structure model optimization

(2014) Robbie P. Joosten et al.   IUCrJ

Cheetah: software for high-throughput reduction and analysis of serial femtosecond X-ray diffraction data

(2014) Anton Barty et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Mix and Inject: Reaction Initiation by Diffusion for Time-Resolved Macromolecular Crystallography

(2013) Marius Schmidt   Advances in Condensed Matter Physics

Structural studies of the effect that dimethyl sulfoxide (DMSO) has on cisplatin and carboplatin binding to histidine in a protein

(2012) Simon W. M. Tanley et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

Experimental Investigation of Inertial Mixing in Colliding Droplets

(2012) Brian Carroll et al.   HEAT TRANSFER ENGINEERING

Experience with exchange and archiving of raw data: comparison of data from two diffractometers and four software packages on a series of lysozyme crystals

(2012) Simon W. M. Tanley et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

A compact X-ray free-electron laser emitting in the sub-ångström region

(2012) Tetsuya Ishikawa et al.   Nature Photonics

High-Resolution Protein Structure Determination by Serial Femtosecond Crystallography

(2012) S. Boutet et al.   SCIENCE

Linking Crystallographic Model and Data Quality

(2012) P. A. Karplus et al.   SCIENCE

Solvation properties of N-acetyl-β-glucosamine: Molecular dynamics study incorporating electrostatic polarization

(2011) Yang Zhong et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Features and development ofCoot

(2010) P. Emsley et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

electronic Ligand Builder and Optimization Workbench(eLBOW): a tool for ligand coordinate and restraint generation

(2009) Nigel W. Moriarty et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY