3NEZ
mRojoA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-02-05 |
Detector | MAR CCD 165 mm |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 61.240, 97.410, 84.160 |
Unit cell angles | 90.00, 95.54, 90.00 |
Refinement procedure
Resolution | 30.480 - 1.700 |
R-factor | 0.184 |
Rwork | 0.182 |
R-free | 0.22100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2h5q |
RMSD bond length | 0.023 |
RMSD bond angle | 2.017 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.000 | 1.790 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.042 | 0.393 |
Number of reflections | 102737 | |
<I/σ(I)> | 11.9 | 2.2 |
Completeness [%] | 95.4 | |
Redundancy | 2.3 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 298 | 200 mM ammonium acetate, 100 mM Bis-Tris, pH 6.5, and 25% (w/v) polyethylene glycol 3350, VAPOR DIFFUSION, HANGING DROP, temperature 298K |