3UNV
Pantoea agglomerans Phenylalanine Aminomutase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Detector technology | CCD |
| Collection date | 2011-04-16 |
| Wavelength(s) | 0.97872 |
| Spacegroup name | C 2 2 2 |
| Unit cell lengths | 153.964, 185.844, 72.560 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.540 |
| R-factor | 0.2062 |
| Rwork | 0.204 |
| R-free | 0.24710 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.134 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.570 |
| High resolution limit [Å] | 1.540 | 4.180 | 1.540 |
| Rmerge | 0.138 | 0.038 | |
| Number of reflections | 142758 | ||
| <I/σ(I)> | 5 | ||
| Completeness [%] | 93.0 | 99.6 | 72.5 |
| Redundancy | 5.6 | 7.1 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | hanging drop | 7.5 | 298 | 0.1 M Tris-HCl, 2.5 M lithium sulfate, pH 7.5, hanging drop, temperature 298K |
