5M7H
Crystal structure of Bacillus subtilis EngA in complex with phosphate ion and GMPPNP
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 | PIXEL |
| Collection date | 2015-02-02 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.873 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.930, 63.880, 62.450 |
| Unit cell angles | 90.00, 97.34, 90.00 |
Refinement procedure
| Resolution | 61.940 - 3.150 |
| R-factor | 0.2258 |
| Rwork | 0.221 |
| R-free | 0.31821 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4dcu |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.185 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 61.940 | 3.230 |
| High resolution limit [Å] | 3.150 | 3.150 |
| Rmerge | 0.442 | |
| Number of reflections | 6198 | |
| <I/σ(I)> | 7 | 2.25 |
| Completeness [%] | 88.5 | 92.1 |
| Redundancy | 2.6 | 2.69 |
| CC(1/2) | 0.987 | 0.815 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293.15 | 0.2 M sodium/potassium phosphate 0.1 M Tris pH 6.5 16% PEG 3350 |
