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Diffraction images for yeast 5-aminolevulinic acid dehydratase complexed with the inhibitor 5-hydroxylevulinic acid.

Diffraction images for a co-crystal of 5-aminolaevulinic acid dehydratase (ALAD) from yeast with the competitive inhibitor 5-hydroxylevulinic acid extending to a resolution of 1.9 Å. The data were collected at beamline ID29 at ESRF in Feb 2002 using an ADSC detector.

X-ray diffraction images for yeast 5-aminolevulinic acid dehydratase complexed with 4-oxosebacic acid.

X-ray diffraction images for yeast 5-aminolaevulinic acid dehydratase complexed with 4-oxosebacic acid which were collected using beamline ID14-2 at the ESRF (Grenoble) in Feb 2001.

X-ray diffraction images for the H145E mutant of the iron-dependent superoxide dismutase from Mycobacterium tuberculosis.

X-ray diffraction images of the H145E mutant (prefixed h145e) which were collected in October 1995 using a graphite-monochromated copper K-alpha rotating anode source (wavelength 1.5418 Å) with a Marresearch 90 cm image plate detector at a distance of 120 mm from the crystal. The data were collected at room temperature in two passes, each consisting of 100 one degree rotations of the crystal. Each image had an exposure time of 20 minutes. The crystal was rotated in the capillary tube prior to collection of the second pass in order to record the 'blind' region of the diffraction pattern and this set of images is prefixed h145eb.

X-ray diffraction images for the H145Q mutant of the iron-dependent superoxide dismutase from Mycobacterium tuberculosis.

X-ray diffraction images collected from one crystal at room temperature using a rotating anode copper source (wavelength 1.5418 Å) and a 30 cm Marresearch image plate detector. The crystal-to-detector distance was 150 mm and a 90 mm image plate scan radius was used. Each of the 60 images had an exposure time of 20 minutes and corresponds to a 3 degree phi-rotation of the crystal. Diffraction extends to about 3.3 Å resolution.

X-ray diffraction images for bovine inositol monophosphatase.

X-ray diffraction images for bovine inositol monophosphatase which were collected using the ESRF beamline ID14-4 to a resolution of around 1.4 Å. The data were collected in two passes, the second for measuring intensities that were overloaded in the first. More details are given in the included notes.

X-ray diffraction images for 5-aminolevulinic acid dehydratase (ALAD) from E. coli.

X-ray diffraction images for Escherichia coli 5-aminolevulinic acid dehydratase (ALAD) which was crystallised in the presence of the inhibitor levulinic acid (15 mM) and bismuth nitrate (1 mM). The data were collected at beamline 9.6 at the SRS Daresbury Laboratory (UK) on 10th March 1994 using a 30 cm Marresearch image plate detector, a crystal temperature of 100 K, a wavelength of 0.88 Å and a crystal-to-detector distance was 300 mm. The oscillation angle was 2.5 degrees and 21 images were collected at constant dose in the time available. A wax image for determining the direct beam position was taken with the detector at a distance of 400 mm.

X-ray diffraction images for yeast 5-aminolevulinic acid dehydratase complexed with 4-keto-5-aminohexanoic acid.

X-ray diffraction images which were collected at the EMBL beamline BW7B, DESY (Hamburg) on 28th June 1999 using a Marresearch 345 image plate detector. The data were collected in three passes, images in the first main one having file prefix hykah, the second being a low-resolution run (lr) and, the last, a very high resolution (vhr) pass. More details are given in the notebook pages.

X-ray diffraction images for yeast 5-aminolevulinic acid dehydratase complexed with succinylacetone.

X-ray diffraction images which were collected on 28th March 1999 at the EMBL beamline BW7B at DESY (Hamburg) using a Marresearch 345 image plate detector. More information in the notes.

X-ray diffraction images of yeast 5-aminolevulinic acid dehydratase complexed with substrate 5-aminolevulinic acid.

X-ray diffraction images collected at the BW7B beamline at DESY (Hamburg) on 2 Jun 1998. More details in the notes.

X-ray diffraction images of endothiapepsin complexed with the norstatine inhibitor CP-80,794.

X-ray diffraction images of endothiapepsin complexed with CP-80,794 collected at ESRF beamline ID14-2 on 28th April 2001 to 0.98 Å resolution. More details in the included notes.

X-ray diffraction images of endothiapepsin complexed with the inhibitor H256.

X-ray diffraction images for endothiapepsin complexed with the reduced bond inhibitor H256 collected at ESRF beamline ID14-2.

SC-XRD diffraction images of stereo-defined piperazine (2/2)

Structures of a piperazine in the publication: Suarez-Pantiga, S.; Colas, K.; Johansson, M. J.; Mendoza, A.* "Scalable synthesis of piperazines enabled by visible light irradiation and aluminum organometallics" Angew. Chem. Int. Ed. 2015, 54, 14094–14098 Structure solutions were deposited in the CCDC: 1052437 (3b - PiPy3Me) https://www.ccdc.cam.ac.uk/structures-beta/Search?id=doi:10.1002/anie.201505608

SC-XRD diffraction images of stereo-defined piperazines (1/2)

Structures of two piperazines in the publication: Suarez-Pantiga, S.; Colas, K.; Johansson, M. J.; Mendoza, A.* "Scalable synthesis of piperazines enabled by visible light irradiation and aluminum organometallics" Angew. Chem. Int. Ed. 2015, 54, 14094–14098 Structure solutions were deposited in the CCDC: 1052438 (3g - PiPy5Br) and 1053734 (3ij - PiPyzIm) https://www.ccdc.cam.ac.uk/structures-beta/Search?id=doi:10.1002/anie.201505608

Atomic resolution X-ray diffraction images for endothiapepsin complexed with a cyclic statine inhibitor.

X-ray diffraction images for endothiapepsin complexed with inhibitor CP-129,541. The data were collected on 29th April 2001.

opencc-by-4.0Feb 2017View details →

X-ray diffraction images of endothiapepsin complexed with the phosphostatine inhibitor PD-130,328.

X-ray diffraction images collected at the ESRF (Grenoble) beamline ID14-2 using an ADSC Quantum 4R CCD detector on 9 Apr 2000.

Raw diffraction images of polyhedra in-vivo crystals

Diffraction images of wild type cypovirus polyhedra in-vivo crystals (WTPhC) and the mutant (Δ3-PhC) related to PDB codes 5GQM and 5GQN, respectively. Small-wedge (5°/crystal) datasets were collected from loop-harvested microcrystals using EIGER X 9M detector at a wavelength of 1 Å on BL32XU, SPring-8. The datasets for 5GQN were collected automatically using ZOO system. The crystals belonged to space group I23 with unit cell parameter a~103 Å. 14 and 41 datasets were merged at 1.68 and 1.55 Å resolution in the published result (Abe et al. ACS Nano 2017; PDB codes: 5GQM & 5GQN, respectively) using KAMO; see https://github.com/keitaroyam/yamtbx/wiki/Processing-Polyhedra-data-(5GQM-&-5GQN) NOTE <ul> <li> flatfield correction was not applied to the images and you need to apply it using the correction table saved in master.h5 files. </li> <li> master.h5 files were modified; see https://github.com/keitaroyam/yamtbx/blob/master/doc/eiger-en.md </li> <li> Most frames have ice (rings). </li> </ul>

opencc-by-4.0Apr 2024View details →

Raw diffraction images of the crystal structure of human VISTA extra cellular domain in complex with Fab fragment of pH-selective anti-VISTA antibody

The diffraction datasets was collected at X10SA, SLS. The dataset was collected from one crystal using a rotation scheme for 222º oscillation with the following experimental parameters; Wavelength: 0.9998 Å, Detector: EIGER2 Si 16M (DECTRIS Co. Ltd.). The crystal belonged to space group C 1 2 1 with unit cell parameters a=207.66, b=39.51, c=177.98 Å, and beta=117.12°.PDB ID: 8TBQ

opencc-by-4.0Mar 2024View details →

Data and code associated with "Fourier synthesis optical diffraction tomography for kilohertz rate volumetric imaging"

Imaging data and derived analysis data used in the figures of the manuscript "Fourier synthesis optical diffraction tomography for kilohertz rate volumetric imaging"

opencc-by-sa-4.0Jun 2020View details →

Diffraction images of a crystal of the F-BAR domain of PSTPIP1 (Proline-serine-threonine phosphatase-interacting protein 1) mutant G258A (PDB entry 7AAL)

Diffraction images of a crystal of the F-BAR domain of PSTPIP1 (residues 1-289), mutant G258A. Data were collected on a single crystal at the beamline i03 of the Diamond Light Source synchrotron (Didcot, UK) using radiation of 0.9999 Å wavelength and a PILATUS3 6M detector. The dataset consists of 2400 images (0.15 degree oscillation per image). Crystals belong to the space group P2(1)2(1)2(1) with unit cell dimensions a=48.19 Å, b=73.02 Å, c=205.25 Å. The asymmetric unit contains an homodimer of the F-BAR domain (~53% solvent content), which is the biological unit. Diffraction data was notably anisotropic. The lowest resolution limit was 2.92 Å in the direction b* and the highest limits were 1.97 Å and 2.09 in the directions a* and c*, respectively.   The structure derived form these data is published in: Manso, J.A., Marcos, T., Ruiz-Martín, V. Casas J, Alcón P, Sánchez Crespo M, Bayón Y, de Pereda JM, Alonso A PSTPIP1-LYP phosphatase interaction: structural basis and implications for autoinflammatory disorders. Cell. Mol. Life Sci. 79, 131 (2022). <a href="https://doi.org/10.1007/s00018-022-04173-w">https://doi.org/10.1007/s00018-022-04173-w</a> The structure is available at the PDB under the code 7AAL: <a href="https://www.ebi.ac.uk/pdbe/entry/pdb/7aal">https://www.ebi.ac.uk/pdbe/entry/pdb/7aal</a>