2FRK
Nitrosyl Horse Heart Myoglobin, Nitric Oxide Gas Method
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-02-01 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9611 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.516, 28.605, 63.294 |
Unit cell angles | 90.00, 105.65, 90.00 |
Refinement procedure
Resolution | 9.890 - 1.300 |
R-factor | 0.17028 |
Rwork | 0.168 |
R-free | 0.20477 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.138 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 9.890 | 1.330 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.055 | |
Number of reflections | 30078 | |
<I/σ(I)> | 9.9 | |
Completeness [%] | 98.7 | 98.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 295 | Ammonium Sulfate, Tris-HCl, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 295K |