4DSH
Crystal structure of reduced UDP-Galactopyranose mutase
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 | 2011-11-16 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97949 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 143.840, 143.840, 354.389 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.901 - 2.250 |
R-factor | 0.1816 |
Rwork | 0.180 |
R-free | 0.20980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ute |
RMSD bond length | 0.007 |
RMSD bond angle | 1.106 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX (1.6.2_432) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 47.080 | 47.080 | 2.370 |
High resolution limit [Å] | 2.250 | 7.120 | 2.250 |
Rmerge | 0.089 | 0.526 | |
Total number of observations | 29200 | 107552 | |
Number of reflections | 102978 | ||
<I/σ(I)> | 17.6 | 3.7 | |
Completeness [%] | 99.21 | 99.76 | |
Redundancy | 8.2 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 1.0 M ammonium sulfate, 0.5% PEG8000, 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |