5GKC
The crystal structure of the CPS-6 H148A/F122A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL15A1 |
| Synchrotron site | NSRRC |
| Beamline | BL15A1 |
| Temperature [K] | 193 |
| Detector technology | CCD |
| Collection date | 2015-03-24 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.614, 45.630, 80.988 |
| Unit cell angles | 90.00, 103.20, 90.00 |
Refinement procedure
| Resolution | 27.535 - 1.892 |
| R-factor | 0.2011 |
| Rwork | 0.198 |
| R-free | 0.24940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3s5b |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.152 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.8_1059) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.535 | 1.920 |
| High resolution limit [Å] | 1.892 | 1.890 |
| Number of reflections | 40272 | |
| <I/σ(I)> | 16.8 | |
| Completeness [%] | 99.7 | |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 279 | 0.1 M Sodium citrate tribasic dihydrate (pH 5.5), 22% PEG 1000 |
