3ZWK
The 3-dimensional structure of MpgP from Thermus thermophilus HB27, in complex with the metavanadate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-10 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.968, 71.364, 92.974 |
| Unit cell angles | 90.00, 95.46, 90.00 |
Refinement procedure
| Resolution | 46.276 - 2.099 |
| R-factor | 0.1583 |
| Rwork | 0.155 |
| R-free | 0.21080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zty |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.979 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 2.230 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.050 | 0.290 |
| Number of reflections | 30243 | |
| <I/σ(I)> | 16.78 | 4.47 |
| Completeness [%] | 99.0 | 96.5 |
| Redundancy | 3.4 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | pH 6.5 |
