6D2G
Crystal structure of Corynebacterium diphtheriae UDP-galactopyranose mutase in complex with UDP-galactopyranose (open, reduced)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-01-03 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97856 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 98.240, 98.240, 127.970 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.218 - 2.500 |
R-factor | 0.1643 |
Rwork | 0.162 |
R-free | 0.20280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5br7 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.125 |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.3.11) |
Phasing software | PHASER (2.5.6) |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 36.220 | 36.220 | 2.600 |
High resolution limit [Å] | 2.500 | 9.010 | 2.500 |
Rmerge | 0.124 | 0.055 | 0.895 |
Rmeas | 0.126 | 0.056 | 0.912 |
Rpim | 0.024 | 0.012 | 0.174 |
Number of reflections | 41383 | 555 | 2481 |
<I/σ(I)> | 18 | ||
Completeness [%] | 100.0 | 98.2 | 100 |
Redundancy | 27.5 | 22 | 26.9 |
CC(1/2) | 0.999 | 0.999 | 0.937 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 100 mM Tris, 28% PEG400, 20% isopropanol |