6GT6
Crystal structure of recombinant coagulation factor beta-XIIa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-04-24 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 106.932, 106.932, 65.962 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.820 - 2.540 |
| R-factor | 0.2141 |
| Rwork | 0.211 |
| R-free | 0.26360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4xde |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.434 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0222) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.820 | 2.610 |
| High resolution limit [Å] | 2.540 | 2.540 |
| Rpim | 0.102 | |
| Number of reflections | 13130 | 938 |
| <I/σ(I)> | 5.6 | |
| Completeness [%] | 100.0 | |
| Redundancy | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 292.15 | 0.1M Tris.Cl pH 8.0, 1.5M AmSO4 |
