9HWH
Bacterial protein - unliganded
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-11-08 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 88.355, 96.124, 102.843 |
| Unit cell angles | 90.00, 106.42, 90.00 |
Refinement procedure
| Resolution | 48.920 - 1.850 |
| R-factor | 0.1818 |
| Rwork | 0.181 |
| R-free | 0.20980 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.849 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.920 | 1.916 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.064 | 0.734 |
| Rmeas | 0.069 | 0.792 |
| Number of reflections | 140533 | 13964 |
| <I/σ(I)> | 21.47 | 2.25 |
| Completeness [%] | 99.9 | |
| Redundancy | 7 | |
| CC(1/2) | 0.998 | 0.806 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 13% (w/v) PEG 4000, 100 mM HEPES pH 7.3, 100 mM sodium acetate |
