Table 3. Data collection and processing.
| Structure | L702H/H875Y/F877L/T878A | L702H/H875Y/F877L | H875Y/F877L/T878A | F877L/T878A | L702H/H875Y |
|---|---|---|---|---|---|
| PDB code | 8fgy | 8fgz | 8fh0 | 8fh1 | 8fh2 |
| Diffraction source | 24-ID-C, APS | 24-ID-E, APS | 24-ID-C, APS | 24-ID-C, APS | 24-ID-C, APS |
| Wavelength (Å) | 0.97895 | 0.97918 | 0.97918 | 0.97918 | 0.97918 |
| Temperature (K) | 100 | 100 | 100 | 100 | 100 |
| Detector | Dectris EIGER2 16M | Dectris EIGER2 16M | Dectris EIGER2 16M | Dectris EIGER2 16M | Dectris EIGER2 16M |
| Crystal-to-detector distance (mm) | 230 | 180 | 200 | 230 | 200 |
| Rotation range per image (°) | 0.2 | 0.2 | 0.2 | 0.2 | 0.2 |
| Total rotation range (°) | 140 | 200 | 200 | 200 | 250 |
| Exposure time per image (s) | 0.2 | 0.2 | 0.2 | 0.2 | 0.2 |
| Space group | P212121 | P212121 | P212121 | P212121 | P212121 |
| a, b, c (Å) | 56.41, 66.10, 73.38 | 56.74, 66.08, 73.07 | 56.52, 65.98, 73.14 | 56.35, 66.06, 73.17 | 56.88, 65.86, 72.65 |
| α, β, γ (°) | 90, 90, 90 | 90, 90, 90 | 90, 90, 90 | 90, 90, 90 | 90, 90, 90 |
| Mosaicity (°) | 0.25 | 0.14 | 0.11 | 0.14 | 0.11 |
| Resolution range (Å) | 50–2.19 (2.33–2.19) | 50–1.61 (1.70–1.61) | 50–1.59 (1.69–1.59) | 50–1.69 (1.80–1.69) | 50–1.59 (1.69–1.59) |
| Total No. of reflections | 75325 | 266841 | 271984 | 224108 | 338075 |
| No. of unique reflections | 14426 | 36469 | 37224 | 30925 | 37114 |
| Completeness (%) | 98.8 (99.2) | 99.7 (98.7) | 99.8 (99.2) | 99.5 (98.1) | 99.9 (99.5) |
| Multiplicity | 5.2 (5.5) | 7.3 (6.9) | 7.3 (7.4) | 7.2 (7.6) | 9.1 (9.2) |
| 〈I/σ(I)〉 | 8.8 (2.6) | 25.4 (1.9)† | 22.8 (2.6) | 20.9 (2.0) | 19.5 (2.6) |
| R meas (%) | 19.8 (88.5) | 3.5 (103) | 4.0 (71.6) | 4.4 (105) | 6.2 (104) |
| CC1/2 | 0.992 (0.786) | 1.00 (0.785) | 0.999 (0.909) | 0.999 (0.865) | 0.999 (0.872) |
| Overall B factor from Wilson plot (Å2) | 26 | 29 | 28 | 31 | 27 |
Note: I/σ(I) = 3.7 at 1.70 Å resolution.