4HA1
MutB inactive double mutant D200A-D415N in complex with isomaltulose
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 | 2009-09-26 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.87260 |
| Spacegroup name | P 1 |
| Unit cell lengths | 64.600, 73.350, 82.640 |
| Unit cell angles | 66.55, 73.86, 71.86 |
Refinement procedure
| Resolution | 43.360 - 2.200 |
| R-factor | 0.1946 |
| Rwork | 0.192 |
| R-free | 0.25130 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2pwh |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.763 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC (5) |
| Refinement software | REFMAC (5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.400 | 2.500 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.441 | |
| Number of reflections | 64580 | |
| <I/σ(I)> | 8.49 | 3.95 |
| Completeness [%] | 97.5 | 97.1 |
| Redundancy | 3.1 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 292 | 20% PEG10000, 0.1M TRIS-HCL , pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 292K |
