3GKR
Crystal Structure of Weissella viridescens FemX:UDP-MurNAc-hexapeptide complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-02-11 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.97985 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.324, 101.836, 46.847 |
| Unit cell angles | 90.00, 102.85, 90.00 |
Refinement procedure
| Resolution | 27.200 - 1.600 |
| R-factor | 0.17513 |
| Rwork | 0.173 |
| R-free | 0.21561 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ne9 |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.349 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.200 | 1.700 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.033 | 0.139 |
| Number of reflections | 50198 | |
| <I/σ(I)> | 18.4 | 5.6 |
| Completeness [%] | 98.4 | 96.2 |
| Redundancy | 1.7 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 30% PEG6000, 0.3M chlorure de sodium, 0.01M chlorure de magnesium, 0.07M sulfate d'ammonium, pH6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
