5ZKU
Crystal structure of DFA-IIIase from Arthrobacter chlorophenolicus A6 in complex with DFA-III
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-07-30 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 116.466, 77.175, 139.718 |
| Unit cell angles | 90.00, 99.60, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.320 |
| R-factor | 0.19078 |
| Rwork | 0.188 |
| R-free | 0.24004 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.447 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.360 |
| High resolution limit [Å] | 2.320 | 2.320 |
| Rmerge | 0.067 | 0.361 |
| Number of reflections | 92637 | |
| <I/σ(I)> | 19 | |
| Completeness [%] | 91.3 | |
| Redundancy | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 287 | 10% PEG 3350, 0.1M Sodium malonate (pH 4.2) |
