5XT2
Crystal structures of full-length FixJ from B. japonicum crystallized in space group P212121
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-10-04 |
Detector | RAYONIX MX225-HS |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.722, 137.910, 142.276 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.512 - 2.652 |
R-factor | 0.2083 |
Rwork | 0.206 |
R-free | 0.24850 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.345 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.11.1_2575)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.700 |
High resolution limit [Å] | 2.650 | 2.650 |
Rmerge | 0.061 | 1.127 |
Rpim | 0.012 | 0.266 |
Number of reflections | 47221 | 2050 |
<I/σ(I)> | 60.3 | 2 |
Completeness [%] | 99.6 | 95.1 |
Redundancy | 28.2 | 17.4 |
CC(1/2) | 0.952 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | pentaerythritol ethoxylate, magnesium formate, glycerol, Tris-HCL |