6O9F
The structure of Thermomyces Lanuginosa lipase in complex with 1,3 diacylglycerol in a monoclinic crystal form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2016-05-15 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5419 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 78.185, 91.366, 124.316 |
Unit cell angles | 90.00, 94.70, 90.00 |
Refinement procedure
Resolution | 51.270 - 2.480 |
R-factor | 0.1768 |
Rwork | 0.175 |
R-free | 0.21450 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.521 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASER |
Refinement software | PHENIX (1.19rc7_4070) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.000 | 2.520 |
High resolution limit [Å] | 2.480 | 2.480 |
Rmerge | 0.292 | 1.020 |
Rmeas | 0.327 | 1.300 |
Rpim | 0.102 | 0.623 |
Number of reflections | 81074 | 4362 |
<I/σ(I)> | 7.1 | 1.3 |
Completeness [%] | 100.0 | 96.2 |
Redundancy | 9.6 | 3.9 |
CC(1/2) | 0.979 | 0.180 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | Protein source was a filtered fungal culture medium at about 50 mg/ml. This was combined in 8 ul drops with equal amounts of 25% PEG 3350 buffered at pH 6.5 with 0.10 M MES and crystallized at room temperature by sitting drops in Cryschem plates |