7OME
Azacoelenterazine-bound Renilla-type engineered ancestral luciferase variant (AncFT7)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-07-12 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 43.076, 64.487, 98.096 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.441 - 1.501 |
| R-factor | 0.1693 |
| Rwork | 0.168 |
| R-free | 0.19020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2psj |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.3) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 43.080 | 43.080 | 1.530 |
| High resolution limit [Å] | 1.500 | 8.220 | 1.500 |
| Rmerge | 0.211 | 0.032 | 1.495 |
| Rmeas | 0.221 | 0.034 | 1.659 |
| Rpim | 0.063 | 0.010 | 0.691 |
| Total number of observations | 508534 | 3425 | 10816 |
| Number of reflections | 44303 | 336 | 1993 |
| <I/σ(I)> | 12.7 | 45.3 | 1.4 |
| Completeness [%] | 99.4 | 99.6 | 92.1 |
| Redundancy | 11.5 | 10.2 | 5.4 |
| CC(1/2) | 0.998 | 1.000 | 0.440 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293.15 | PEG1500, SPG buffer |
