8XHT
The apo structure of PaBcmG
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-06-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9785 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.331, 103.396, 91.072 |
| Unit cell angles | 90.00, 89.97, 90.00 |
Refinement procedure
| Resolution | 42.059 - 1.820 |
| R-factor | 0.201063549681 |
| Rwork | 0.199 |
| R-free | 0.23562 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7v3o |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.889 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER (1.11.1_2575) |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.850 |
| High resolution limit [Å] | 1.819 | 1.820 |
| Rmerge | 0.113 | 0.469 |
| Rpim | 0.047 | 0.205 |
| Number of reflections | 118876 | 5553 |
| <I/σ(I)> | 14.4 | 3 |
| Completeness [%] | 99.1 | 92 |
| Redundancy | 6.6 | 5.6 |
| CC(1/2) | 0.989 | 0.940 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 10% w/v PEG 4000, 20% v/v glycerol 0.03 M of each NPS (0.3 M sodium nitrate, 0.3 M disodium hydrogen phosphate, 0.3 M ammonium sulfate), 0.1 M MES/imidazole pH 6.5 |
