4FU0
Crystal Structure of VanG D-Ala:D-Ser Ligase from Enterococcus faecalis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2009-03-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.98011 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 116.070, 116.070, 177.228 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 33.500 - 2.350 |
| R-factor | 0.19026 |
| Rwork | 0.189 |
| R-free | 0.22412 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1e4e |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.402 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.510 | 2.480 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.066 | 0.778 |
| Number of reflections | 57000 | |
| <I/σ(I)> | 12.3 | 1.9 |
| Completeness [%] | 98.5 | 98.6 |
| Redundancy | 3.7 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 291 | 0.5M ammonium sulfate, 0.9M lithium sulfate, 0.1M sodium citrate, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
