4U7X
Crystal structure of Fructokinase from Brucella abortus 2308
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] | 100 |
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 | 103.900, 103.900, 61.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.465 - 2.100 |
R-factor | 0.217 |
Rwork | 0.215 |
R-free | 0.25200 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.996 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX ((phenix.refine: dev_1760)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 2.150 | ||
High resolution limit [Å] | 2.100 | 9.390 | 2.100 |
Rmerge | 0.054 | 0.023 | 0.494 |
Rmeas | 0.055 | 0.024 | 0.520 |
Total number of observations | 331382 | ||
Number of reflections | 20243 | 275 | 1479 |
<I/σ(I)> | 33.45 | 74 | 4.68 |
Completeness [%] | 99.9 | 95.5 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 290 | 2.4 M Sodium Malonate |