5XTU
Crystal Structure of GDSL Esterase of Photobacterium sp. J15
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-07-22 |
| Detector | RIGAKU |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.182, 66.461, 105.468 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 56.230 - 1.380 |
| R-factor | 0.159 |
| Rwork | 0.158 |
| R-free | 0.17900 |
| Structure solution method | SAD |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.524 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.230 | 1.430 |
| High resolution limit [Å] | 1.380 | 1.380 |
| Rmerge | 0.070 | 0.193 |
| Rpim | 0.070 | |
| Number of reflections | 70491 | |
| <I/σ(I)> | 25 | 5.7 |
| Completeness [%] | 98.2 | 95.3 |
| Redundancy | 2 | 1.98 |
| CC(1/2) | 0.912 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.10 M ammonium sulphate, 0.15 M sodium cacodylate trihydrate pH 6.5, and 20% PEG 8000 |
