5IFH
Crystal structure of the BCR Fab fragment from subset #2 case P11475
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-02-02 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97241 |
| Spacegroup name | P 41 |
| Unit cell lengths | 65.872, 65.872, 111.233 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 65.870 - 2.293 |
| R-factor | 0.183 |
| Rwork | 0.180 |
| R-free | 0.20890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1adq |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.746 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 65.870 | 2.370 |
| High resolution limit [Å] | 2.290 | 2.290 |
| Rmerge | 1.840 | |
| Number of reflections | 21207 | |
| <I/σ(I)> | 121.7 | 2.9 |
| Completeness [%] | 99.3 | 93 |
| Redundancy | 7.1 | 7.4 |
| CC(1/2) | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.1 M BisTris pH 5.5, 200 mM MgCl2, 20% PEG 3350 |
