3T2G
Fructose-1,6-bisphosphate aldolase/phosphatase from Thermoproteus neutrophilus, Y229F variant with 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 | 112.430, 112.430, 151.520 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.720 - 3.000 |
| R-factor | 0.1779 |
| Rwork | 0.175 |
| R-free | 0.23403 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3t2b |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.600 |
| 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] | 47.721 | 3.160 |
| High resolution limit [Å] | 2.998 | 3.000 |
| Rmerge | 0.180 | 0.599 |
| Number of reflections | 10089 | |
| <I/σ(I)> | 10.7 | 3 |
| Completeness [%] | 99.3 | 99.6 |
| Redundancy | 6.4 | 6.5 |
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 |
