6Q3T
Structure of Protease1 from Pyrococcus horikoshii at room temperature in ChipX microfluidic device
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2018-04-10 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.2 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 125.560, 125.560, 133.870 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.790 - 2.150 |
| R-factor | 0.1638 |
| Rwork | 0.163 |
| R-free | 0.18470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g2i |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.095 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.790 | 2.210 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.169 | |
| Rpim | 0.038 | |
| Number of reflections | 57690 | |
| <I/σ(I)> | 12 | |
| Completeness [%] | 98.7 | |
| Redundancy | 19 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | COUNTER-DIFFUSION | 293 | 2.0 to 3.4M Sodium Malonate pH 6.0, 10mM Xo4 |
