7QYC
As isolated MSOX movie series dataset 20 (8 MGy) of the copper nitrite reductase from Bradyrhizobium sp. ORS 375 (two-domain)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-04-06 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 0.99999 |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 107.374, 107.374, 107.374 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.070 - 1.350 |
| R-factor | 0.12749 |
| Rwork | 0.126 |
| R-free | 0.14836 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7qy4 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.966 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.070 | 1.370 |
| High resolution limit [Å] | 1.350 | 1.350 |
| Rmerge | 0.037 | 0.506 |
| Rmeas | 0.040 | 0.641 |
| Rpim | 0.015 | 0.388 |
| Number of reflections | 88590 | 3756 |
| <I/σ(I)> | 23.8 | 1.9 |
| Completeness [%] | 98.1 | |
| Redundancy | 5.7 | |
| CC(1/2) | 1.000 | 0.657 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 297 | 1.8 M (NH4)2SO2 and 50mM HEPES buffer pH 5 |
