6NQ8
Crystal structure of YetJ mutant from Bacillus Subtilis - D171E
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-09-30 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9792 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 218.090, 117.296, 52.407 |
Unit cell angles | 90.00, 92.97, 90.00 |
Refinement procedure
Resolution | 39.082 - 3.100 |
R-factor | 0.2446 |
Rwork | 0.243 |
R-free | 0.27050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4pgs |
RMSD bond length | 0.002 |
RMSD bond angle | 0.454 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.150 | 3.310 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 76248 | |
<I/σ(I)> | 5.4 | |
Completeness [%] | 99.1 | |
Redundancy | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 0.1 M MOPS, pH 7.5, 38% PEG 400, and 0.2 M NaCl |