3LUY
Putative chorismate mutase from Bifidobacterium adolescentis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-02-13 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9792 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 99.954, 59.198, 63.172 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.700 - 2.000 |
R-factor | 0.194 |
Rwork | 0.192 |
R-free | 0.22500 |
Structure solution method | SAD |
RMSD bond length | 0.021 |
RMSD bond angle | 1.658 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXD |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.700 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.089 | 0.822 |
Number of reflections | 25950 | |
<I/σ(I)> | 10.4 | 2.09 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 6.9 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 297 | 0.2 M potassium chloride, 0.05 M HEPES buffer, 35% pentaerythritol propoxylate (5/4 PO/OH), pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 297K |