6H1Z
AFGH61B WILD-TYPE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-3 |
| Synchrotron site | MAX II |
| Beamline | I911-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-08-24 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.1 |
| Spacegroup name | P 1 |
| Unit cell lengths | 37.670, 43.850, 60.010 |
| Unit cell angles | 89.62, 108.33, 109.20 |
Refinement procedure
| Resolution | 19.430 - 1.570 |
| R-factor | 0.1305 |
| Rwork | 0.129 |
| R-free | 0.16700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zud |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.623 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.610 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Number of reflections | 43815 | |
| <I/σ(I)> | 19.5 | 4.9 |
| Completeness [%] | 91.6 | 51.7 |
| Redundancy | 2.5 | 1.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.2 M sodium thiocyanate pH 6.9, 20 %w/v PEG 3350 (reservoir) |
