4AMX
CRYSTAL STRUCTURE OF THE GRACILARIOPSIS LEMANEIFORMIS ALPHA-1,4- GLUCAN LYASE Covalent Intermediate Complex with 5-fluoro-glucosyl- fluoride
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-07 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 1 |
| Unit cell lengths | 91.643, 97.008, 135.708 |
| Unit cell angles | 80.38, 83.11, 85.22 |
Refinement procedure
| Resolution | 46.740 - 2.100 |
| R-factor | 0.22263 |
| Rwork | 0.220 |
| R-free | 0.26742 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2x2h |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.294 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.700 | 2.210 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.110 | 0.480 |
| Number of reflections | 255868 | |
| <I/σ(I)> | 5.1 | 1.4 |
| Completeness [%] | 96.0 | 92.3 |
| Redundancy | 1.9 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 18-21% PEG 8000, 0.1 M SODIUM ACETATE, PH 5.0-5.2, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K |
