8KFW
Crystal structure of ZmMOC1 K229A in complex with a nicked Holliday junction soaked in Mn2+ for 600 seconds
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2022-11-26 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.5497 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.644, 78.142, 63.621 |
| Unit cell angles | 90.00, 97.72, 90.00 |
Refinement procedure
| Resolution | 49.070 - 2.300 |
| R-factor | 0.2075 |
| Rwork | 0.206 |
| R-free | 0.24140 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6jrg |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.912 |
| Data reduction software | XDS |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21rc1_4958) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.070 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.123 | 0.997 |
| Number of reflections | 23234 | 2266 |
| <I/σ(I)> | 8.5 | 1.7 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 6 | 6.1 |
| CC(1/2) | 0.991 | 0.782 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 298 | 0.1 M MES pH 6.0, 35% Polyethylene glycol 400 |
