8GP0
crystal structure of SulE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-29 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.373, 139.194, 57.913 |
| Unit cell angles | 90.00, 101.29, 90.00 |
Refinement procedure
| Resolution | 47.370 - 1.460 |
| Rwork | 0.152 |
| R-free | 0.16930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7yd2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.876 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (v1.16) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.490 |
| High resolution limit [Å] | 1.460 | 1.460 |
| Rpim | 0.037 | 0.204 |
| Number of reflections | 131514 | 4799 |
| <I/σ(I)> | 20.78 | |
| Completeness [%] | 99.0 | |
| Redundancy | 6.5 | 4.6 |
| CC(1/2) | 0.990 | 0.874 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | PEG4000 |
