6LGJ
Crystal structure of an oxido-reductase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Collection date | 2018-12-11 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.140, 112.170, 84.830 |
| Unit cell angles | 90.00, 93.01, 90.00 |
Refinement procedure
| Resolution | 47.979 - 2.400 |
| R-factor | 0.161 |
| Rwork | 0.159 |
| R-free | 0.21590 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4wnc |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.025 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.980 | 2.486 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Number of reflections | 49776 | 4985 |
| <I/σ(I)> | 5.18 | |
| Completeness [%] | 95.7 | |
| Redundancy | 3.1 | |
| CC(1/2) | 0.978 | 0.927 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.1M Tris, pH8.5, 25% PEG 3350 |
