8IBJ
Inactive mutant of CtPL-H210S/F214I/N181A/F235L
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | LIQUID ANODE |
| Source details | BRUKER METALJET |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-10-03 |
| Detector | Bruker PHOTON III |
| Wavelength(s) | 1.34138 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 43.789, 62.405, 157.247 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.630 - 1.920 |
| R-factor | 0.19999 |
| Rwork | 0.197 |
| R-free | 0.26188 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7cwq |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.560 |
| Data reduction software | SAINT |
| Data scaling software | SAINT |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.630 | 1.950 |
| High resolution limit [Å] | 1.920 | 1.920 |
| Rmerge | 0.082 | 0.267 |
| Number of reflections | 16729 | 731 |
| <I/σ(I)> | 14.69 | 3.98 |
| Completeness [%] | 98.7 | 95.3 |
| Redundancy | 6.46 | 4.61 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.8 M lithium chloride, 5% PEG 6000, 0.1 M citric acid (pH 4.0) |
