4WJM
Crystal structure of Fructokinase from Brucella abortus 2308 with bound AMPPNP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 90 |
Detector technology | CCD |
Collection date | 2014-07-16 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.97872 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 109.890, 109.890, 58.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.750 - 1.700 |
R-factor | 0.1712 |
Rwork | 0.170 |
R-free | 0.19540 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.106 |
Data reduction software | XDS |
Data scaling software | XSCALE (2.5.7) |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: dev_1810)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 34.750 | 1.740 | |
High resolution limit [Å] | 1.700 | 7.600 | 1.700 |
Rmerge | 0.072 | 0.031 | 0.533 |
Rmeas | 0.075 | 0.032 | 0.552 |
Total number of observations | 557667 | ||
Number of reflections | 39662 | 527 | 2882 |
<I/σ(I)> | 25.55 | 49.34 | 5.71 |
Completeness [%] | 100.0 | 99.1 | 100 |
Redundancy | 14.06 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 2.4M Na Malonate pH 7.0 |