5J8F
Human MOF K274P crystal structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-10-31 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.03315 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.094, 55.846, 122.405 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.253 - 2.600 |
| R-factor | 0.2428 |
| Rwork | 0.239 |
| R-free | 0.27570 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5j8c |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.910 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.253 | 2.640 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.112 | 0.649 |
| Number of reflections | 10295 | |
| <I/σ(I)> | 18.05 | 2.5 |
| Completeness [%] | 99.9 | 99.8 |
| Redundancy | 5.9 | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.28M Ammonium Chloride 26%PEG 3350 0.1M BisTris-HCl pH 6.5 |
