8U5G
Crystal structure of the co-expressed SDS22:PP1:I3 complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-05-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 334.795, 334.795, 334.795 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.460 - 3.200 |
| R-factor | 0.2112 |
| Rwork | 0.209 |
| R-free | 0.23970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.939 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.1_4122: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.590 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.072 | 1.254 |
| Rmeas | 0.074 | 1.315 |
| Rpim | 0.019 | 0.358 |
| Total number of observations | 1407248 | 69627 |
| Number of reflections | 27016 | 4425 |
| <I/σ(I)> | 21.9 | 1.7 |
| Completeness [%] | 98.7 | |
| Redundancy | 16.4 | 15.7 |
| CC(1/2) | 0.968 | 0.939 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.2 | 289 | 1.8 M sodium phosphate monobasic monohydrate, potassium phosphate dibasic pH 8.2 |
