5GZI
Cyclodeaminase_PA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-08-28 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5417 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 136.926, 74.060, 95.718 |
| Unit cell angles | 90.00, 132.72, 90.00 |
Refinement procedure
| Resolution | 47.840 - 2.170 |
| R-factor | 0.181 |
| Rwork | 0.178 |
| R-free | 0.22800 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.652 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.210 |
| High resolution limit [Å] | 2.170 | 2.170 |
| Rmerge | 0.085 | 0.491 |
| Number of reflections | 37354 | |
| <I/σ(I)> | 13.53 | 2.62 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 3.5 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 2%(v/v) polyethylene glycol 400, 0.1M HEPES |
