4X7B
Crystal Structure of lipase from Geobacillus stearothermophilus T6 methanol stable variant H86Y/A269T
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-04-07 |
| Detector | RIGAKU RAXIS |
| Wavelength(s) | 1.56 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.810, 71.750, 114.360 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.272 - 2.400 |
| R-factor | 0.2063 |
| Rwork | 0.204 |
| R-free | 0.24760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.723 |
| Data scaling software | SCALA (3.3.20) |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 60.778 | 34.230 | 2.530 |
| High resolution limit [Å] | 2.400 | 7.590 | 2.400 |
| Rmerge | 0.044 | 0.178 | |
| Rmeas | 0.092 | ||
| Rpim | 0.052 | 0.026 | 0.121 |
| Total number of observations | 48982 | 1834 | 7366 |
| Number of reflections | 16204 | ||
| <I/σ(I)> | 10 | 15.4 | 5.1 |
| Completeness [%] | 97.8 | 92.8 | 99.8 |
| Redundancy | 3 | 3.3 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2M sodium citrate, 25% PEG3350 |
