6ISA
mCD226
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-06-10 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97930 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.319, 65.771, 70.465 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.950 - 2.000 |
R-factor | 0.2148 |
Rwork | 0.213 |
R-free | 0.23990 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6isb |
RMSD bond length | 0.002 |
RMSD bond angle | 0.527 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.088 | 0.270 |
Rpim | 0.038 | 0.128 |
Number of reflections | 16031 | 1536 |
<I/σ(I)> | 17.117 | |
Completeness [%] | 97.6 | 95.5 |
Redundancy | 5.6 | 5 |
CC(1/2) | 1.000 | 0.953 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1 M Na HEPES (pH 7.5), 10 % (w/v) PEG 8000, and 8% (v/v) ethylene glycol |