4H1D
Cocrystal structure of GlpG and DFP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-12-01 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.1 |
Spacegroup name | H 3 2 |
Unit cell lengths | 110.073, 110.073, 123.995 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.787 - 2.897 |
R-factor | 0.2339 |
Rwork | 0.232 |
R-free | 0.26930 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.158 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CCP4 |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 40.000 |
High resolution limit [Å] | 2.897 |
Number of reflections | 6580 |
Completeness [%] | 99.0 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 7 | 298 | 0.1 M bis-tris propane 1.5 M NH4Cl, pH 7, EVAPORATION, temperature 298K |