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Forschungszentrum Jülich> Forschungszentrum Jülich

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85748 Garching

SCXRD: The single crystal X-ray diffractometer

The Rigaku single crystal X-ray diffractometer with the Oxford cryosystems Cryostream in the parking position. A capillary crystal is mounted on the goniometer. © Bernhard Ludewig, FRM II / TUM

The Rigaku single crystal X-ray diffractometer with the Oxford cryosystems Cryostream in the parking position. A capillary crystal is mounted on the goniometer. © Bernhard Ludewig, FRM II / TUM

To complement the single crystal neutron instruments HEIDI and BIODIFF, an x-ray twin has been installed. The instrument comprises two microfocus X-ray sources, one with Molybdenum and one with Copper K radiation. These two sources make the instrument suitable for both small molecule and protein crystallography.

The sample area can be as large as a sphere with a radius of 4 cm. This makes it possible to accommodate high pressure cells or glass capillaries for room temperature operation. An Oxford Cryosystems Cryostream is available for low temperature operation down to 80 K.

An optical stereo microscope can be used for crystal mounting of small crystals. It is equipped with a camera which can record images with a known scale bar. This can be used to assess the crystal volume and morphology. Crossed polarizers can be used in transmission mode in order to see the birefringence of transparent crystals. This often helps to identify crystals of good scattering quality.

Technical data of the Synergy-S

• Four circle kappa geometry goniometer with a sphere of confusion of less than 7 µm
• Mo-K𝛼 Microfocus source, 𝛌 =0.707 Å
• Cu-K𝛼 Microfocus source, 𝛌 =1.5406 Å with adjustable divergence between 1 to 10 mrad
• HyPix-Arc 150 detector with a 2-Theta coverage of 150° at 60 mm sample to detector distance
• Automatic data reduction and refinement pipeline for small molecules
• Powder diffraction option using glass capillaries

Sample environment

• Oxford Cryosystems Cryostream for temperatures between 80 K and 500 K
• Collision model for up to 10 cm long glass capillaries with diameters of up to 5 mm
• Plate reader for 96-well plates

Typical Applications

• Determination of crystal quality
• Determination of twin laws
• Diffuse scattering assessment
• Full data set recording for later refinement
• Crystal screening with the 96-well plate reader

Contact

Dr. Tobias Schrader
Email: t.schrader@fz-juelich.de
Phone: +49 (0)89 158860-743

SCXRD-Lab (UYL 123)
Phone: +49 (0)89 158860-123

Gallery

Close-up of the single-crystal X-ray diffractometer

© Bernhard Ludewig, FRM II / TUM

Close-up of the single-crystal X-ray diffractometer

© Bernhard Ludewig, FRM II / TUM

Close-up of the single-crystal X-ray diffractometer

© Bernhard Ludewig, FRM II / TUM

Close-up of the single-crystal X-ray diffractometer

© Bernhard Ludewig, FRM II / TUM

Close-up of the single-crystal X-ray diffractometer

© Bernhard Ludewig, FRM II / TUM

MLZ is a cooperation between:

Technische Universität München> Technische Universität MünchenHelmholtz-Zentrum Hereon> Helmholtz-Zentrum Hereon
Forschungszentrum Jülich> Forschungszentrum Jülich

MLZ is a member of:

LENS> LENSERF-AISBL> ERF-AISBL

MLZ on social media: