4AIH
Crystal structure of RovA from Yersinia in its free form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 67.160, 74.780, 181.150 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 90.570 - 2.400 |
R-factor | 0.22262 |
Rwork | 0.220 |
R-free | 0.26612 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3deu |
RMSD bond length | 0.008 |
RMSD bond angle | 1.244 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 90.000 | 2.460 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.010 | 0.070 |
Number of reflections | 36510 | |
<I/σ(I)> | 16.8 | 2.9 |
Completeness [%] | 99.8 | 100 |
Redundancy | 5.9 | 6.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1 M MES PH 6.5, 20% PEG2000MME |