3V2V
Nitrite Bound Chlorin Substituted Myoglobin- Method 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2010-06-21 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 34.432, 30.519, 63.579 |
Unit cell angles | 90.00, 105.23, 90.00 |
Refinement procedure
Resolution | 26.230 - 1.650 |
R-factor | 0.1932 |
Rwork | 0.192 |
R-free | 0.21760 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ba2 |
RMSD bond length | 0.022 |
RMSD bond angle | 2.017 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.450 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.035 | 0.163 |
Number of reflections | 15443 | |
<I/σ(I)> | 17.8 | 5.3 |
Completeness [%] | 98.7 | 95.8 |
Redundancy | 3.13 | 3.08 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 295 | ammonium sulfate, 100mM TrisHCl, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 295K |