5DQM
Green/cyan WasCFP at pH 2.0
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-04-20 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 47.268, 51.528, 47.529 |
| Unit cell angles | 90.00, 97.70, 90.00 |
Refinement procedure
| Resolution | 22.280 - 1.300 |
| R-factor | 0.1632 |
| Rwork | 0.162 |
| R-free | 0.20820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5dqb |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.505 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 1.350 |
| High resolution limit [Å] | 1.300 | 2.800 | 1.300 |
| Rmerge | 0.048 | 0.022 | 0.582 |
| Total number of observations | 205757 | ||
| Number of reflections | 53938 | ||
| <I/σ(I)> | 9.6 | ||
| Completeness [%] | 96.4 | 97.4 | 93.6 |
| Redundancy | 3.8 | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 2 | 293 | 0.1 M Citric acid pH 5.5, 1 M LiCl, 30 % PEG 6000. Prior to data collection pH of the cryoprotectant was adjusted to 2.0 by citric acid |
