6IKJ
Crystal structure of YfiB(F48S)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-03-17 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9791 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.206, 56.300, 139.896 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.956 - 1.760 |
| R-factor | 0.1945 |
| Rwork | 0.192 |
| R-free | 0.23020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4zhw |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.992 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.210 | 1.790 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.091 | 0.448 |
| Number of reflections | 29728 | 1335 |
| <I/σ(I)> | 32.2 | 2.4 |
| Completeness [%] | 98.9 | 92.6 |
| Redundancy | 6.1 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 2.0M (NH4)2SO4, 0.1M CAPS pH 10.5, 0.2 M Li2SO4 |
