Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-06-28 |
Detector | MARMOSAIC 300 mm CCD |
Spacegroup name | H 3 2 |
Unit cell lengths | 95.889, 95.889, 795.391 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.270 - 2.150 |
R-factor | 0.262 |
Rwork | 0.261 |
R-free | 0.29100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB entries 3GQ7 3gqh |
RMSD bond length | 0.007 |
RMSD bond angle | 1.088 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.270 | 2.230 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.146 | 0.446 |
Number of reflections | 68349 | |
<I/σ(I)> | 17.143 | |
Completeness [%] | 88.0 | 57 |
Redundancy | 15.6 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 3.0 M Sodium Acetate at pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |