4BAB
Redesign of a Phenylalanine Aminomutase into a beta-Phenylalanine Ammonia Lyase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Collection date | 2011-12-04 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 94.136, 132.095, 110.035 |
| Unit cell angles | 90.00, 95.52, 90.00 |
Refinement procedure
| Resolution | 109.520 - 2.560 |
| R-factor | 0.2159 |
| Rwork | 0.214 |
| R-free | 0.25103 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yii |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.953 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.520 | 2.700 |
| High resolution limit [Å] | 2.560 | 2.560 |
| Rmerge | 0.070 | 0.420 |
| Number of reflections | 83419 | |
| <I/σ(I)> | 13.7 | 3.1 |
| Completeness [%] | 97.3 | 89.8 |
| Redundancy | 3.8 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2 M NA FORMATE, 20 % W/V PEG 3350, 2 MM DTT |
