5LA5
Room temperature X-ray diffraction of tetragonal HEWL. Second data set (0.62 MGy)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 298 |
| Detector technology | PIXEL |
| Collection date | 2015-12-11 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.984001 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 79.285, 79.285, 37.880 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.640 - 1.700 |
| R-factor | 0.14554 |
| Rwork | 0.143 |
| R-free | 0.18490 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 1bwh |
| RMSD bond length | 0.024 |
| RMSD bond angle | 2.114 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.640 | 1.730 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.051 | 0.305 |
| Number of reflections | 13826 | |
| <I/σ(I)> | 24.7 | 6 |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 6.3 | 6.3 |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.7 | 291 | protein: 50 mg/ml of HEWL in mQ crystallization solution: 200mM NaAcetate pH 4.7 + 10% NaCl |
