2BW5
Atomic Resolution Structure of NO-bound Achromobacter cycloclastes Cu Nitrite Reductase
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 |
Collection date | 2005-01-30 |
Detector | MARRESEARCH |
Spacegroup name | P 21 3 |
Unit cell lengths | 95.334, 95.334, 95.334 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.120 |
R-factor | 0.129 |
Rwork | 0.128 |
R-free | 0.16400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2bw4 |
RMSD bond length | 0.021 |
RMSD bond angle | 2.136 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.9999) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.500 | 1.160 |
High resolution limit [Å] | 1.120 | 1.120 |
Rmerge | 0.050 | 0.400 |
Number of reflections | 108076 | |
<I/σ(I)> | 19.5 | 2.5 |
Completeness [%] | 97.8 | 88 |
Redundancy | 4.4 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.75 | 1.6 M SODIUM PHOSPHATE, 100MM SODIUM ACETATE, PH 4.75 |