7AKT
CrPetF variant - A39G_A41V
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-06-19 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 25.966, 51.231, 32.255 |
| Unit cell angles | 90.00, 112.13, 90.00 |
Refinement procedure
| Resolution | 25.810 - 1.110 |
| R-factor | 0.1767 |
| Rwork | 0.175 |
| R-free | 0.19130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6lk1 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.247 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX (Version 1.14-3260) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.900 | 1.140 |
| High resolution limit [Å] | 1.110 | 1.110 |
| Rmerge | 0.065 | 0.783 |
| Number of reflections | 31128 | 2302 |
| <I/σ(I)> | 8.92 | |
| Completeness [%] | 99.4 | |
| Redundancy | 3.38 | |
| CC(1/2) | 0.997 | 0.566 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 281.15 | 2 % (w/v) benzamidine hydrochloride, 1.8 M (NH4)2SO4 and 0.2 M NaSCN in 0.1 M sodium citrate buffer |
