8ZIJ
The holo structure of gamma-lyase CndF
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 | 2021-07-18 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9785 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 85.432, 102.527, 128.124 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.600 - 2.590 |
| R-factor | 0.2163 |
| Rwork | 0.214 |
| R-free | 0.25490 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.783 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.600 | 2.710 |
| High resolution limit [Å] | 2.590 | 2.590 |
| Rmerge | 0.199 | 1.462 |
| Rpim | 0.082 | 0.583 |
| Number of reflections | 35765 | 4321 |
| <I/σ(I)> | 9.6 | 2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 13.1 | 13.8 |
| CC(1/2) | 0.995 | 0.755 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293.15 | 0.2M sodium sulfate, 0.1M Bis-Tris propane pH 6.5, 20% PEG 3350 |
