Table 2. Summary of the X-ray diffraction experiments of H-PGDS crystals.
The best data of the X-ray diffraction experiments on two to three crystals for each complex of H-PGDS with compound are shown. Data sets were collected up to the resolution range I/σ(I) > 2 and R merge < 50%. Data shown in bold face were used for data comparison between space-grown and ground-grown crystals (see text for details). All of the data except S2 were collected at SPring-8 BL41XU beamline.
| Space experiment | Ground experiment | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Sample ID | Maximum resolution (visual observation) (Å) | Maximum resolution (data set) (Å) | Mosaicity | Space group | Sample ID | Maximum resolution (visual observation) (Å) | Maximum resolution (data set) (Å) | Mosaicity | Space group | Flight # |
| S1 | <1.10 | 1.10 | 0.623 | P1 | G1 | 1.50 | 1.80 | 0.812 | P1 | JAXA-NGCF#1 |
| S2† | 1.20 | 1.20 | 0.178 | P1 | G2 | 2.00 | –‡ | 1.736 | P1 | JAXA-NGCF#1 |
| S3 | 1.12 | 1.14 | 0.560 | P1 | G3 | 2.00 | –† | 3.386 | P1 | JAXA-NGCF#1 |
| S4 | 1.90 | 1.90 | 1.334 | P1 | G4 | 2.00 | 2.00 | 1.528 | P1 | JAXA-NGCF#1 |
| S5 | 1.30 | 1.30 | 1.707 | P1 | G5 | 1.50 | 1.50 | 1.281 | P1 | JAXA-NGCF#1 and #2 |
| S6§ | 1.50 | 1.50 | 0.36–0.54 | P21 | G6§ | 1.70 | 1.75 | 1.05–2.47 | P21 | JAXA-NGCF#1 and #2 |
| S7§ | 1.40 | 1.40 | 1.329 | P1 | G7§ | –¶ | JAXA–NGCF#1 | |||
| S8§ | 1.26 | 1.30 | 1.109 | P1 | G8§ | 2.50 | 2.50 | 1.305 | P1 | JAXA-NGCF#1 |
| S9 | 1.40 | 1.78 | 0.43–1.48 | P1 | G9 | 2.00 | –†† | JAXA-NGCF#2 | ||
| S10 | 1.30 | 1.50 | 0.66–1.03 | P1 | G10 | 2.10 | –†† | JAXA-NGCF#2 | ||
| S11 | –‡‡ | G11 | –‡‡ | JAXA-NGCF#3 | ||||||
| S12 | 1.80 | 1.90 | 0.60–1.12 | P21 | G12 | –¶ | JAXA-NGCF#3 | |||
| S13 | 1.47 | 1.48 | 0.63–1.43 | P1 | G13 | –¶ | JAXA-NGCF#3 | |||
| S14 | 1.40 | 1.68 | 0.61–1.01 | P21 | G14 | 1.66 | 1.70 | 0.61–4.48 | P1 | JAXA-NGCF#3 |
| S15 | –¶ | G15 | –¶ | JAXA-NGCF#3 | ||||||
| S16 | –¶ | G16 | –¶ | JAXA-NGCF#3 | ||||||
| S17 | 1.80 | 1.80 | 0.35–0.93 | P21 | G17 | –¶ | JAXA-NGCF#3 | |||
| S18 | 1.80 | –‡ | – | I41 | G18 | –¶ | JAXA PCG#1 | |||
| S19 | 1.10 | 1.32 | 0.25–0.42 | P1 | G19 | –¶ | JAXA PCG#1 | |||
| S20 | –§§ | G20 | –§§ | JAXA PCG#1 | ||||||
| S21 | –§§ | G21 | –§§ | JAXA PCG#1 | ||||||
| S22 | –§§ | G22 | –§§ | JAXA PCG#1 | ||||||
| S23 | 1.45 | 1.50 | 0.34–0.65 | P1 | G23 | 1.35 | 1.50 | 0.48–1.53 | P1 | JAXA PCG#1 |
| S24 | 1.75 | –†† | 0.940 | P1 | G24 | –†† | JAXA PCG#1 | |||
| S25 | 1.76 | 1.78 | 0.40–0.74 | P21 | G25 | –§§ | JAXA PCG#1 | |||
X-ray diffraction data set was collected at SLS beamline X06SA.
X-ray diffraction data set was not collected because of high mosaicity.
Inhibitor-free condition.
Beam time was not available.
X-ray diffraction data set was not collected because the crystals were too small.
No crystallization was observed.
X-ray diffraction experiment was not performed because the crystal was a cluster and not suitable for diffraction experiment.