7OUR
Wilavidin apo form (P1 form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-10-11 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.96546 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.320, 56.721, 62.641 |
| Unit cell angles | 103.53, 110.75, 105.63 |
Refinement procedure
| Resolution | 46.700 - 1.950 |
| R-factor | 0.1823 |
| Rwork | 0.180 |
| R-free | 0.22590 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7ouq |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.721 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.700 | 2.000 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Number of reflections | 40032 | 2788 |
| <I/σ(I)> | 5.6 | |
| Completeness [%] | 94.6 | |
| Redundancy | 1.7 | |
| CC(1/2) | 0.910 | 0.674 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.6 M sodium citrate tribasic pH 6.5 |
