3WV7
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 | 2013-04-10 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 68.390, 73.520, 68.580 |
| Unit cell angles | 90.00, 118.05, 90.00 |
Refinement procedure
| Resolution | 19.930 - 1.600 |
| R-factor | 0.1671 |
| Rwork | 0.165 |
| R-free | 0.19870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zud |
| RMSD bond length | 0.023 |
| RMSD bond angle | 2.308 |
| 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 | 1.850 | |
| High resolution limit [Å] | 1.600 | 12.000 | 1.600 |
| Rmerge | 0.028 | 0.012 | 0.267 |
| Rmeas | 0.015 | 0.318 | |
| Number of reflections | 78396 | 201 | 27667 |
| <I/σ(I)> | 24.03 | 88.41 | 5.41 |
| Completeness [%] | 98.9 | 93.9 | 99.3 |
| Redundancy | 3.35 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 298 | 15%(w/v) PEG6000, 0.1M sodium citrate, pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
