6ZII
Structure of the isolated REC domain of RcsB from Salmonella enterica serovar Typhimurium in the presence of phosphomimetic BeF3-
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-05 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.96862 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.144, 64.400, 47.131 |
| Unit cell angles | 90.00, 100.14, 90.00 |
Refinement procedure
| Resolution | 28.710 - 2.500 |
| R-factor | 0.2258 |
| Rwork | 0.222 |
| R-free | 0.27770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5o8z |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.206 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.2.8) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 28.710 | 28.710 | 2.620 |
| High resolution limit [Å] | 2.500 | 8.290 | 2.500 |
| Rmerge | 0.073 | 0.059 | 0.243 |
| Rmeas | 0.079 | 0.064 | 0.273 |
| Rpim | 0.031 | 0.025 | 0.120 |
| Total number of observations | 1400 | 4022 | |
| Number of reflections | 7616 | 223 | 839 |
| <I/σ(I)> | 16.1 | 30.7 | 6.5 |
| Completeness [%] | 97.0 | 97.8 | 81.3 |
| Redundancy | 6.4 | 6.3 | 4.8 |
| CC(1/2) | 0.997 | 0.998 | 0.949 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 30% PEG 4000, Tris-HCl pH 8.5, 0.2M MgCl2 |
