6S3V
Crystal Structure of lipase from Geobacillus stearothermophilus T6 methanol stable variant E251C/G332C
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-03-06 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97625 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.160, 71.970, 112.640 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.320 - 2.000 |
Rwork | 0.228 |
R-free | 0.23930 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4x6u |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.320 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.115 | 0.424 |
Rmeas | 0.132 | 0.491 |
Number of reflections | 37629 | 5453 |
<I/σ(I)> | 7.5 | 2.7 |
Completeness [%] | 99.3 | 99.9 |
Redundancy | 4.1 | 4 |
CC(1/2) | 0.995 | 0.845 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.2M sodium citrate, 22% PEG 3350 |