5E76
Crystal structure of Bacova_02651 with xylogluco-oligosaccharide
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 | 2014-10-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.979 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 131.500, 131.500, 188.040 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.130 - 2.300 |
R-factor | 0.219 |
Rwork | 0.217 |
R-free | 0.25300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5e75 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.379 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.130 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.718 | |
Number of reflections | 36775 | |
<I/σ(I)> | 24.9 | 6.71 |
Completeness [%] | 99.6 | 99.4 |
Redundancy | 29 | 28.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 298 | 1.2-1.8 sodium citrate |