2V1E
Crystal structure of radiation-induced myoglobin compound II - intermediate H at pH 6.8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM1A |
| Synchrotron site | ESRF |
| Beamline | BM1A |
| Temperature [K] | 110 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-06-21 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.071, 28.706, 35.463 |
| Unit cell angles | 90.00, 105.94, 90.00 |
Refinement procedure
| Resolution | 26.750 - 1.300 |
| R-factor | 0.15 |
| Rwork | 0.148 |
| R-free | 0.17600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gjn |
| RMSD bond length | 0.052 |
| RMSD bond angle | 1.075 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.100 | 1.370 |
| High resolution limit [Å] | 1.130 | 1.300 |
| Rmerge | 0.050 | 0.310 |
| Number of reflections | 29634 | |
| <I/σ(I)> | 8.98 | 2.43 |
| Completeness [%] | 97.9 | 98 |
| Redundancy | 2.56 | 2.18 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.8 | BATCH METHOD: 6-12 MG/ML MYOGLOBIN, 80-85% OF THE CRYSTALLIZATION STOCK-SOLUTION (3.9 M AMMONIUM SULPHATE, 0.1 M MOPS AND 5-10% OF GLYCEROL), pH 6.80 |
