7VDO
Crystal structure of KRED F147L/L153Q/Y190P variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-06-06 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97913 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 127.610, 55.440, 128.950 |
| Unit cell angles | 90.00, 103.94, 90.00 |
Refinement procedure
| Resolution | 31.902 - 1.856 |
| R-factor | 0.159038385072 |
| Rwork | 0.158 |
| R-free | 0.19811 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4rf2 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.951 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 61.930 | 1.900 |
| High resolution limit [Å] | 1.855 | 1.855 |
| Rmerge | 0.069 | 0.504 |
| Rmeas | 0.075 | 0.574 |
| Rpim | 0.030 | 0.265 |
| Number of reflections | 73460 | 5113 |
| <I/σ(I)> | 15.4 | 2.7 |
| Completeness [%] | 98.8 | 93.4 |
| Redundancy | 6.2 | 4.4 |
| CC(1/2) | 0.998 | 0.822 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 0.1 M Bis-Tris pH 6.5, 25% (w/v) PEG 3350, 0.2 M MgCl2 |
