3LR7
Ferric horse heart myoglobin, nitrite adduct
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-09-19 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.266, 28.532, 62.932 |
Unit cell angles | 90.00, 105.43, 90.00 |
Refinement procedure
Resolution | 21.850 - 1.600 |
R-factor | 0.1957 |
Rwork | 0.193 |
R-free | 0.24750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | : 1dwr |
RMSD bond length | 0.007 |
RMSD bond angle | 0.993 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 21.850 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.056 | 0.298 |
Number of reflections | 15927 | |
<I/σ(I)> | 9.9 | 3 |
Completeness [%] | 98.0 | 96 |
Redundancy | 3 | 2.96 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | seeding | 7.4 | 295 | 2.76M ammonium sulfate, 100 mM TrisHCl, 1 mM EDTA, pH 7.4, seeding, temperature 295K |