5I25
human recombinant coagulation FXI in complex with a peptide derived from human high molecular weight kininogen (HKP)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2010-12-17 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.988 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 80.590, 80.590, 251.810 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.790 - 2.850 |
| R-factor | 0.23249 |
| Rwork | 0.226 |
| R-free | 0.28821 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.818 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.790 | |
| High resolution limit [Å] | 2.850 | 2.850 |
| Rmerge | 0.083 | 0.612 |
| Number of reflections | 20319 | |
| <I/σ(I)> | 16 | 16 |
| Completeness [%] | 99.0 | 100 |
| Redundancy | 6 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.4 | 293.15 | PEG1500, HEPES pH 7.4., 0.2M NaCl |
