5ZC1
X-ray diffraction analysis of the CsStefin-1
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
Synchrotron site | PAL/PLS |
Beamline | 7A (6B, 6C1) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-05-11 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.987, 0.97911, 0.97926, 0.97142 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.450, 56.996, 101.134 |
Unit cell angles | 90.00, 99.06, 90.00 |
Refinement procedure
Resolution | 30.513 - 2.303 |
R-factor | 0.222402362696 |
Rwork | 0.218 |
R-free | 0.28610 |
Structure solution method | MAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.185 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.340 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.048 | 0.233 |
Number of reflections | 31360 | |
<I/σ(I)> | 22.9 | |
Completeness [%] | 96.5 | |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 100 mM imidazole (pH 8.0), 2500 mM sodium chloride |