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 |