3WV9
Guanylylpyridinol (GP)- and ATP-bound HcgE from Methanothermobacter marburgensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-11-30 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.008 |
| Spacegroup name | P 3 |
| Unit cell lengths | 85.000, 85.000, 120.780 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.690 - 2.750 |
| R-factor | 0.16759 |
| Rwork | 0.165 |
| R-free | 0.21389 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zud |
| RMSD bond length | 0.021 |
| RMSD bond angle | 2.499 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.850 | |
| High resolution limit [Å] | 2.750 | 12.000 | 2.750 |
| Rmerge | 0.105 | 0.031 | 0.870 |
| Number of reflections | 25386 | ||
| <I/σ(I)> | 15 | 53.27 | 2.47 |
| Completeness [%] | 100.0 | 98.1 | 100 |
| Redundancy | 7.79 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 35%(w/v)pentaerythritol ethoxylate 270, 200mM ammonium sulfate, 100mM sodium acetate, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature Room temperatureK |
