2Y1A
Crystal structure of Achromobacter cycloclastes Cu nitrite reductase with bound NO
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX10.1 |
| Synchrotron site | SRS |
| Beamline | PX10.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 95.240, 95.240, 95.240 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.410 - 1.950 |
| R-factor | 0.15635 |
| Rwork | 0.153 |
| R-free | 0.20951 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2bw4 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.502 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.400 | 2.020 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.040 | 0.080 |
| Number of reflections | 19807 | |
| <I/σ(I)> | 19.6 | 6.7 |
| Completeness [%] | 93.2 | 58.4 |
| Redundancy | 4.4 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4.75 | 1.6M AMMONIUM SULPHATE, 100MM SODIUM ACETATE PH 4.75 |
