3V2Z
Nitrite Bound Chlorin Substituted Myoglobin- Method 2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-05-24 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.285, 30.360, 64.060 |
| Unit cell angles | 90.00, 104.94, 90.00 |
Refinement procedure
| Resolution | 26.500 - 1.650 |
| R-factor | 0.18647 |
| Rwork | 0.184 |
| R-free | 0.23202 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ba2 |
| RMSD bond length | 0.022 |
| RMSD bond angle | 2.135 |
| 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] | 26.500 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.038 | 0.143 |
| Number of reflections | 15230 | |
| <I/σ(I)> | 16.8 | 5.9 |
| Completeness [%] | 97.5 | 94.5 |
| Redundancy | 3.21 | 3.18 |
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 |
