Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2017-06-26 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54187 |
| Spacegroup name | P 6 |
| Unit cell lengths | 189.260, 189.260, 45.880 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 35.770 - 3.400 |
| Rwork | 0.297 |
| R-free | 0.33480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.847 |
| Data reduction software | XDS (Jun 30, 2023 BUILT=20230630) |
| Data scaling software | XSCALE (Jun 30, 2023 BUILT=20230630) |
| Phasing software | PHASER (2.8.3) |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 35.770 | 35.770 | 4.200 |
| High resolution limit [Å] | 3.400 | 4.200 | 3.400 |
| Rmerge | 0.412 | 0.338 | 1.473 |
| Rmeas | 0.435 | 0.357 | 1.553 |
| Rpim | 0.140 | 0.116 | 0.488 |
| Number of reflections | 9185 | 7111 | 2074 |
| <I/σ(I)> | 4.9 | 5.8 | 1.9 |
| Completeness [%] | 68.9 | 99.51 | 33.53 |
| Redundancy | 9.6 | 9.6 | 9.8 |
| CC(1/2) | 0.994 | 0.995 | 0.583 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 40% v/v 2-methyl-2,4-pentanediol; 5% w/v polyethylene glycol 8000; 100 mM 2-(N-morpholino)ethanesulfonic acid; pH 6.5 |
