8VSQ
Crystal structure of Esub1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.1806 |
| Spacegroup name | P 1 2 1 |
| Unit cell lengths | 82.362, 43.872, 85.841 |
| Unit cell angles | 90.00, 118.67, 90.00 |
Refinement procedure
| Resolution | 43.911 - 2.900 |
| Rwork | 0.222 |
| R-free | 0.28060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.814 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.911 | 3.080 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmeas | 0.080 | 0.627 |
| Rpim | 0.043 | 0.334 |
| Number of reflections | 12089 | 1931 |
| <I/σ(I)> | 9.9 | 2 |
| Completeness [%] | 99.0 | 94 |
| Redundancy | 3.4 | |
| CC(1/2) | 0.999 | 0.940 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 278 | 0.2M Lithium sulfate 0.1M Tris pH 8.5 40% PEG 400 12 mg/mL protein |
