4BE9
Open conformation of O. piceae sterol esterase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | I 41 |
Unit cell lengths | 164.123, 164.123, 93.994 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.561 - 2.000 |
R-factor | 0.1694 |
Rwork | 0.168 |
R-free | 0.20590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lpn |
RMSD bond length | 0.008 |
RMSD bond angle | 1.051 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.280 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.110 | 0.810 |
Number of reflections | 84190 | |
<I/σ(I)> | 11.7 | 2.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.2 M SODIUM NITRATE, 0.1 M BIS-TRIS PROPANE PH 7.5, 20% PEG 3350 |