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MHz data collection of a microcrystalline mixture of different jack bean proteins

MHz data collection of a microcrystalline mixture of different jack bean proteins
MHz data collection of a microcrystalline mixture of different jack bean proteins

We provide a detailed description of a serial femtosecond crystallography (SFX) dataset collected at the European X-ray free-electron laser facility (EuXFEL). The EuXFEL is the first high repetition rate XFEL delivering MHz X-ray pulse trains at 10 Hz. The short spacing (<1 µs) between pulses requires fast flowing microjets for sample injection and high frame rate detectors. A data set was recorded of a microcrystalline mixture of at least three different jack bean proteins (urease, concanavalin A, concanavalin B). A one megapixel Adaptive Gain Integrating Pixel Detector (AGIPD) was used which has not only a high frame rate but also a large dynamic range. This dataset is publicly available through the Coherent X-ray Imaging Data Bank (CXIDB) as a resource for algorithm development and for data analysis training for prospective XFEL users.

Grünbein, Marie Luise
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Bielecki, Johan
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Gorel, Alexander
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Stricker, Miriam
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Bean, Richard
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Cammarata, Marco
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Dörner, Katerina
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Fröhlich, Lars
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Hartmann, Elisabeth
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Hauf, Steffen
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Hilpert, Mario
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Kim, Yoonhee
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Kloos, Marco
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Letrun, Romain
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Messerschmidt, Marc
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Mills, Grant
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Nass Kovacs, Gabriela
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Ramilli, Marco
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Roome, Christopher M.
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Sato, Tokushi
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Scholz, Matthias
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Sliwa, Michel
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Sztuk-Dambietz, Jolanta
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Weik, Martin
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Weinhausen, Britta
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Al-Qudami, Nasser
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Boukhelef, Djelloul
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Brockhauser, Sandor
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Ehsan, Wajid
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Emons, Moritz
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Esenov, Sergey
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Fangohr, Hans
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Kaukher, Alexander
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Kluyver, Thomas
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Lederer, Max
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Maia, Luis
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Manetti, Maurizio
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Michelat, Thomas
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Münnich, Astrid
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Pallas, Florent
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Palmer, Guido
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Previtali, Gianpietro
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Raab, Natascha
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Silenzi, Alessandro
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Szuba, Janusz
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Venkatesan, Sandhya
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Wrona, Krzysztof
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Zhu, Jun
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Doak, R. Bruce
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Shoeman, Robert L.
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Foucar, Lutz
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Colletier, Jacques Philippe
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Mancuso, Adrian P.
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Barends, Thomas R.M.
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Stan, Claudiu A.
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Schlichting, Ilme
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Grünbein, Marie Luise
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Bielecki, Johan
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Gorel, Alexander
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Stricker, Miriam
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Bean, Richard
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Cammarata, Marco
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Dörner, Katerina
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Fröhlich, Lars
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Hartmann, Elisabeth
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Hauf, Steffen
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Hilpert, Mario
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Kim, Yoonhee
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Kloos, Marco
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Letrun, Romain
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Messerschmidt, Marc
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Mills, Grant
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Nass Kovacs, Gabriela
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Ramilli, Marco
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Roome, Christopher M.
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Sato, Tokushi
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Scholz, Matthias
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Sliwa, Michel
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Sztuk-Dambietz, Jolanta
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Weik, Martin
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Weinhausen, Britta
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Al-Qudami, Nasser
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Boukhelef, Djelloul
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Brockhauser, Sandor
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Ehsan, Wajid
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Emons, Moritz
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Esenov, Sergey
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Fangohr, Hans
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Kaukher, Alexander
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Kluyver, Thomas
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Lederer, Max
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Maia, Luis
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Manetti, Maurizio
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Michelat, Thomas
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Münnich, Astrid
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Pallas, Florent
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Palmer, Guido
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Previtali, Gianpietro
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Raab, Natascha
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Silenzi, Alessandro
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Szuba, Janusz
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Venkatesan, Sandhya
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Wrona, Krzysztof
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Zhu, Jun
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Doak, R. Bruce
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Shoeman, Robert L.
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Foucar, Lutz
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Colletier, Jacques Philippe
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Mancuso, Adrian P.
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Barends, Thomas R.M.
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Stan, Claudiu A.
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Schlichting, Ilme
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Grünbein, Marie Luise, Bielecki, Johan, Gorel, Alexander, Stricker, Miriam, Bean, Richard, Cammarata, Marco, Dörner, Katerina, Fröhlich, Lars, Hartmann, Elisabeth, Hauf, Steffen, Hilpert, Mario, Kim, Yoonhee, Kloos, Marco, Letrun, Romain, Messerschmidt, Marc, Mills, Grant, Nass Kovacs, Gabriela, Ramilli, Marco, Roome, Christopher M., Sato, Tokushi, Scholz, Matthias, Sliwa, Michel, Sztuk-Dambietz, Jolanta, Weik, Martin, Weinhausen, Britta, Al-Qudami, Nasser, Boukhelef, Djelloul, Brockhauser, Sandor, Ehsan, Wajid, Emons, Moritz, Esenov, Sergey, Fangohr, Hans, Kaukher, Alexander, Kluyver, Thomas, Lederer, Max, Maia, Luis, Manetti, Maurizio, Michelat, Thomas, Münnich, Astrid, Pallas, Florent, Palmer, Guido, Previtali, Gianpietro, Raab, Natascha, Silenzi, Alessandro, Szuba, Janusz, Venkatesan, Sandhya, Wrona, Krzysztof, Zhu, Jun, Doak, R. Bruce, Shoeman, Robert L., Foucar, Lutz, Colletier, Jacques Philippe, Mancuso, Adrian P., Barends, Thomas R.M., Stan, Claudiu A. and Schlichting, Ilme (2019) MHz data collection of a microcrystalline mixture of different jack bean proteins. Scientific Data, 6 (1). (doi:10.1038/s41597-019-0010-0).

Record type: Article

Abstract

We provide a detailed description of a serial femtosecond crystallography (SFX) dataset collected at the European X-ray free-electron laser facility (EuXFEL). The EuXFEL is the first high repetition rate XFEL delivering MHz X-ray pulse trains at 10 Hz. The short spacing (<1 µs) between pulses requires fast flowing microjets for sample injection and high frame rate detectors. A data set was recorded of a microcrystalline mixture of at least three different jack bean proteins (urease, concanavalin A, concanavalin B). A one megapixel Adaptive Gain Integrating Pixel Detector (AGIPD) was used which has not only a high frame rate but also a large dynamic range. This dataset is publicly available through the Coherent X-ray Imaging Data Bank (CXIDB) as a resource for algorithm development and for data analysis training for prospective XFEL users.

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s41597-019-0010-0 - Version of Record
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Accepted/In Press date: 5 February 2019
Published date: 3 April 2019

Identifiers

Local EPrints ID: 431687
URI: https://eprints.soton.ac.uk/id/eprint/431687
PURE UUID: 71e3e73c-48d0-416b-9c54-36e6a206fcac
ORCID for Thomas Kluyver: ORCID iD orcid.org/0000-0003-4020-6364

Catalogue record

Date deposited: 13 Jun 2019 16:30
Last modified: 19 Jul 2019 16:32

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Contributors

Author: Marie Luise Grünbein
Author: Johan Bielecki
Author: Alexander Gorel
Author: Miriam Stricker
Author: Richard Bean
Author: Marco Cammarata
Author: Katerina Dörner
Author: Lars Fröhlich
Author: Elisabeth Hartmann
Author: Steffen Hauf
Author: Mario Hilpert
Author: Yoonhee Kim
Author: Marco Kloos
Author: Romain Letrun
Author: Marc Messerschmidt
Author: Grant Mills
Author: Gabriela Nass Kovacs
Author: Marco Ramilli
Author: Christopher M. Roome
Author: Tokushi Sato
Author: Matthias Scholz
Author: Michel Sliwa
Author: Jolanta Sztuk-Dambietz
Author: Martin Weik
Author: Britta Weinhausen
Author: Nasser Al-Qudami
Author: Djelloul Boukhelef
Author: Sandor Brockhauser
Author: Wajid Ehsan
Author: Moritz Emons
Author: Sergey Esenov
Author: Hans Fangohr
Author: Alexander Kaukher
Author: Thomas Kluyver ORCID iD
Author: Max Lederer
Author: Luis Maia
Author: Maurizio Manetti
Author: Thomas Michelat
Author: Astrid Münnich
Author: Florent Pallas
Author: Guido Palmer
Author: Gianpietro Previtali
Author: Natascha Raab
Author: Alessandro Silenzi
Author: Janusz Szuba
Author: Sandhya Venkatesan
Author: Krzysztof Wrona
Author: Jun Zhu
Author: R. Bruce Doak
Author: Robert L. Shoeman
Author: Lutz Foucar
Author: Jacques Philippe Colletier
Author: Adrian P. Mancuso
Author: Thomas R.M. Barends
Author: Claudiu A. Stan
Author: Ilme Schlichting

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