4FLM
S-formylglutathione Hydrolase W197I Variant containing Copper
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-10-04 |
| Detector | BRUKER SMART 6000 |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 |
| Unit cell lengths | 48.826, 49.203, 66.845 |
| Unit cell angles | 73.92, 80.44, 62.60 |
Refinement procedure
| Resolution | 42.520 - 2.410 |
| R-factor | 0.19455 |
| Rwork | 0.192 |
| R-free | 0.25035 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pv1 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.202 |
| Data reduction software | SAINT |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.520 | 2.510 |
| High resolution limit [Å] | 2.410 | 2.410 |
| Number of reflections | 20473 | |
| <I/σ(I)> | 12.42 | 3.86 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.16 | 6.43 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 290 | 0.17 M ammonium acetate, 0.085 M sodium acetate trihydrate, pH 4.6, 25.5% PEG4000, 15% glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
