4MA4
S-glutathionylated PFKFB3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-05-10 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9792 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 102.508, 102.508, 260.606 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.700 - 2.230 |
R-factor | 0.20154 |
Rwork | 0.199 |
R-free | 0.24181 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.021 |
RMSD bond angle | 2.180 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASES |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.700 | 2.340 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.680 | |
Number of reflections | 37905 | |
Completeness [%] | 99.7 | 90 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 285 | 50 mM MES, pH 6.0, 7% (w/v) polyethylene glycol 4000, VAPOR DIFFUSION, SITTING DROP, temperature 285K |