6Q2M
Crystal structure of Photinus pyralis Luciferase Pps6 mutant in complex with DLSA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 93 |
| Detector technology | PIXEL |
| Collection date | 2018-07-08 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.268, 95.455, 152.020 |
| Unit cell angles | 90.00, 101.56, 90.00 |
Refinement procedure
| Resolution | 44.700 - 2.750 |
| R-factor | 0.1952 |
| Rwork | 0.194 |
| R-free | 0.21800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4g36 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.072 |
| Data reduction software | XDS |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.020 | 2.798 |
| High resolution limit [Å] | 2.750 | 2.751 |
| Rmerge | 0.152 | 0.948 |
| Rmeas | 0.165 | 1.000 |
| Rpim | 0.062 | 0.380 |
| Number of reflections | 46929 | 2392 |
| <I/σ(I)> | 11.8 | 2.3 |
| Completeness [%] | 96.9 | 99.7 |
| Redundancy | 6.9 | 7.1 |
| CC(1/2) | 0.994 | 0.771 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293.15 | 0.05M EPPS pH 8.5, 25% PEG4000, 2% 2,5 Hexanediol |
