4AHZ
Flo5A showing a heptanuclear gadolinium cluster on its surface after 60 min of soaking
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | ENRAF-NONIUS FR591 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-03-02 |
| Detector | MAR scanner 345 mm plate |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.090, 63.160, 105.420 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.170 - 1.900 |
| R-factor | 0.17714 |
| Rwork | 0.177 |
| R-free | 0.20792 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2xjp |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.494 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.270 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.040 | 0.240 |
| Number of reflections | 24900 | |
| <I/σ(I)> | 18.8 | 5.2 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 3.4 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 200 MM BISTRIS PROPANE, 500 MM NACL, 3 MM GDAC3, 20% PEG 4000, pH 7.5 |
