2V9D
Crystal Structure of YagE, a prophage protein belonging to the dihydrodipicolinic acid synthase family from E. coli K12
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-12-04 |
Detector | ADSC CCD |
Wavelength(s) | 0.9794 , 0.9796 , 0.9762 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.279, 149.806, 78.967 |
Unit cell angles | 90.00, 108.42, 90.00 |
Refinement procedure
Resolution | 36.350 - 2.150 |
R-factor | 0.168 |
Rwork | 0.166 |
R-free | 0.21800 |
Structure solution method | MAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.020 |
RMSD bond angle | 1.682 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.230 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.060 | 0.140 |
Number of reflections | 67391 | |
<I/σ(I)> | 19 | |
Completeness [%] | 99.9 | 99.7 |
Redundancy | 7.5 | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.5 | 100MM BIS-TRIS PH 5.5, 200MM MGCL2, 12% PEG 3350 |