4DGI
Structure of POM1 FAB fragment complexed with human PrPc Fragment 120-230
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-16 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.56 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 83.530, 105.920, 76.230 |
| Unit cell angles | 90.00, 95.08, 90.00 |
Refinement procedure
| Resolution | 35.194 - 2.400 |
| R-factor | 0.2594 |
| Rwork | 0.258 |
| R-free | 0.28930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 2.045 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.500 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.190 | 0.780 |
| Number of reflections | 26309 | |
| <I/σ(I)> | 6.8 | 2.3 |
| Completeness [%] | 99.3 | 99.3 |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | 25% PEG3350, 0.1M MES, 0.1M sodium acetate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
