5BSY
Crystal structure of GII.10 P domain in complex with lemon juice
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-11-04 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9845 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.080, 79.750, 69.470 |
Unit cell angles | 90.00, 100.98, 90.00 |
Refinement procedure
Resolution | 43.446 - 1.600 |
R-factor | 0.1615 |
Rwork | 0.160 |
R-free | 0.18860 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3onu |
RMSD bond length | 0.007 |
RMSD bond angle | 1.050 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 43.450 | 1.640 | |
High resolution limit [Å] | 1.600 | 7.150 | 1.600 |
Rmerge | 0.056 | 0.018 | 0.661 |
Rmeas | 0.064 | 0.020 | 0.755 |
Total number of observations | 397784 | ||
Number of reflections | 91761 | 1071 | 6666 |
<I/σ(I)> | 15.04 | 63.4 | 1.8 |
Completeness [%] | 99.5 | 98.2 | 98.4 |
Redundancy | 4.3 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | sodium nitrate, bis-tris propane, PEG3350 |