5D4H
High-resolution nitrite complex of a copper nitrite reductase determined by synchrotron radiation crystallography
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 | CCD |
| Collection date | 2015-02-05 |
| Detector | RIGAKU SATURN A200 |
| Wavelength(s) | 0.95000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 61.419, 102.174, 145.791 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.510 - 1.300 |
| R-factor | 0.12529 |
| Rwork | 0.123 |
| R-free | 0.16475 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.422 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.350 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Number of reflections | 224672 | |
| <I/σ(I)> | 32.6 | 2.9 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 9.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.1 | 293 | 100mM sodium acetate (pH 4.1) and 7% PEG 4000 |
