7SLH
Engineered sperm whale myoglobin-based carbene transferase MbBTIC-C3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-06-05 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.05 |
| Spacegroup name | P 6 |
| Unit cell lengths | 90.519, 90.519, 45.374 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.270 - 1.150 |
| R-factor | 0.108 |
| Rwork | 0.107 |
| R-free | 0.12570 |
| Structure solution method | FOURIER SYNTHESIS |
| Data reduction software | XDS (Feb 5, 2021) |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHENIX (1.19.2_4158) |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.270 | 1.170 |
| High resolution limit [Å] | 1.150 | 1.150 |
| Rpim | 0.025 | 0.153 |
| Number of reflections | 135716 | 2538 |
| <I/σ(I)> | 15.9 | 3.4 |
| Completeness [%] | 96.4 | 68.9 |
| Redundancy | 8.8 | 3.9 |
| CC(1/2) | 0.998 | 0.918 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.8 | 293.15 | 2.4 M Ammonium Sulfate, 20 mM Tris-HCl pH 8.8, 0.1 mM EDTA |
