4ZE8
PBP AccA from A. tumefaciens C58
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-06-09 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.950, 179.350, 81.600 |
| Unit cell angles | 90.00, 93.51, 90.00 |
Refinement procedure
| Resolution | 40.880 - 1.720 |
| R-factor | 0.168 |
| Rwork | 0.166 |
| R-free | 0.19700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4OUP |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.030 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 1.820 |
| High resolution limit [Å] | 1.710 | 1.710 |
| Number of reflections | 215029 | |
| <I/σ(I)> | 8.9 | |
| Completeness [%] | 96.7 | 82.7 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 25% PEG 8K, 5% GLYCEROL, 0.1M ACETATE NA PH 4.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K |
