2VUH
Crystal structure of the D55E mutant of the HupR receiver domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 32 1 2 |
Unit cell lengths | 81.782, 81.782, 61.046 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.520 - 2.500 |
R-factor | 0.22204 |
Rwork | 0.221 |
R-free | 0.24714 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2jk1 |
RMSD bond length | 0.017 |
RMSD bond angle | 1.763 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.520 | 2.600 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.060 | 0.340 |
Number of reflections | 7797 | |
<I/σ(I)> | 26.5 | 6.4 |
Completeness [%] | 99.0 | 99.9 |
Redundancy | 8.1 | 8.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 2.4 M NACL, 0.2 M MGCL2, 0.1 M TRIS-HCL PH 8.0, 28% ETHYLENE GLYCOL |