4BDW
The structure of the FnI-EGF tandem domain of coagulation factor XII in complex with Holmium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-05-16 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 96.245, 96.245, 47.331 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.123 - 2.501 |
| R-factor | 0.2193 |
| Rwork | 0.219 |
| R-free | 0.23470 |
| Structure solution method | SIRAS |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.699 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.120 | 2.620 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.100 | 0.350 |
| Number of reflections | 4061 | |
| <I/σ(I)> | 28.4 | 4.3 |
| Completeness [%] | 99.6 | 97.1 |
| Redundancy | 10.9 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 0.1 M TRIS, 16-18% PEG4,000, 0.2 M POTASSIUM ACETATE SOAKED IN SAME BUFFER WITH 10 MM HOLMIUM CHLORIDE, pH 8.5 |
