7BMY
p62PH in cesium chloride (0.7 M CsCl in crystallization condition and cryo protectant)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-11-24 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.77114 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 34.426, 106.791, 75.870 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.670 - 1.800 |
R-factor | 0.1847 |
Rwork | 0.183 |
R-free | 0.21450 |
Structure solution method | SAD |
RMSD bond length | 0.020 |
RMSD bond angle | 2.108 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 43.670 | 43.670 | 1.840 |
High resolution limit [Å] | 1.800 | 9.000 | 1.800 |
Rmerge | 0.150 | 0.105 | 1.359 |
Rmeas | 0.152 | 0.107 | 1.392 |
Rpim | 0.026 | 0.018 | 0.293 |
Total number of observations | 4358 | 10544 | |
Number of reflections | 12670 | 137 | 487 |
<I/σ(I)> | 22 | 50.8 | 2.7 |
Completeness [%] | 94.9 | 99.5 | 65.1 |
Redundancy | 33 | 31.8 | 21.7 |
CC(1/2) | 0.999 | 0.999 | 0.851 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293.15 | 0.7 M cesium chloride, 18 % (w/v) PEG 4000 |