5LG5
Crystal structure of allantoin racemase from Pseudomonas fluorescens AllR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-02-10 |
| Detector | ADSC QUANTUM 4r |
| Wavelength(s) | 0.97372 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.220, 142.320, 146.020 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.780 - 2.100 |
| R-factor | 0.1882 |
| Rwork | 0.186 |
| R-free | 0.23260 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5fld |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.221 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8_1069) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.780 | 2.210 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.068 | 0.329 |
| Number of reflections | 74201 | |
| <I/σ(I)> | 11.4 | 3.3 |
| Completeness [%] | 99.4 | 96.9 |
| Redundancy | 3.8 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 0.2M CaCl2, 0.1M HEPES pH 7.5, 28% w/v PEG 400 |
