5SWV
Dehydroquinate dehydratase and shikimate dehydrogenase from S. pombe AroM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-06-30 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | .978 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 121.797, 121.797, 191.851 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.000 - 2.650 |
R-factor | 0.19632 |
Rwork | 0.194 |
R-free | 0.23279 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.359 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.700 |
High resolution limit [Å] | 2.650 | 2.650 |
Rmerge | 0.197 | 0.931 |
Number of reflections | 24880 | |
<I/σ(I)> | 12.9 | 1.7 |
Completeness [%] | 99.4 | 98 |
Redundancy | 9.9 | 6.5 |
CC(1/2) | 0.778 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 297 | Protein: 6.0 mg/ml, 10 mM Tris (pH 8.3), 1 mM TCEP Crystallization condition 0.2 M Potassium thiocynate and 20% PEG 3350 |