6WYU
Crystallographic trimer of metal-free TriCyt2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-03-15 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.953680 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 48.258, 79.753, 50.785 |
Unit cell angles | 90.00, 105.06, 90.00 |
Refinement procedure
Resolution | 40.245 - 1.760 |
R-factor | 0.171 |
Rwork | 0.170 |
R-free | 0.19050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2bc5 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.896 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.14-3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.245 | 1.823 |
High resolution limit [Å] | 1.760 | 1.760 |
Rmerge | 0.416 | 0.416 |
Rmeas | 0.451 | 0.451 |
Rpim | 0.173 | 0.173 |
Number of reflections | 36758 | 3676 |
<I/σ(I)> | 3.05 | 2.4 |
Completeness [%] | 99.7 | 99.95 |
Redundancy | 6.3 | 6.3 |
CC(1/2) | 0.918 | 0.930 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 43% MPD, 0.2 M (NH4)2SO4, 0.1 M Tris (pH 8.5) |