3T2F
Fructose-1,6-bisphosphate aldolase/phosphatase from Thermoproteus neutrophilus, soaked with EDTA and DHAP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 90 |
Detector technology | PIXEL |
Collection date | 2010-08-01 |
Detector | PSI PILATUS 6M |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 112.300, 112.300, 151.190 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.660 - 1.900 |
R-factor | 0.15312 |
Rwork | 0.151 |
R-free | 0.19066 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3t2b |
RMSD bond length | 0.033 |
RMSD bond angle | 2.306 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.661 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.083 | 0.714 |
Number of reflections | 38337 | |
<I/σ(I)> | 16.6 | 2.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 5.8 | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 294 | 8% PEG3350, 0.1 M HEPES/NaOH, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |