3ECZ
Carbonmonoxy Sperm Whale Myoglobin at 120 K: Laser on [30 min]
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW14A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW14A |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2007-05-26 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.827 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.425, 30.720, 63.843 |
| Unit cell angles | 90.00, 105.54, 90.00 |
Refinement procedure
| Resolution | 15.660 - 1.210 |
| R-factor | 0.145 |
| Rwork | 0.143 |
| R-free | 0.18200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mbc |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.787 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.250 |
| High resolution limit [Å] | 1.210 | 2.610 | 1.210 |
| Rmerge | 0.052 | 0.040 | 0.256 |
| Number of reflections | 38789 | ||
| <I/σ(I)> | 13.2 | ||
| Completeness [%] | 98.1 | 95.7 | 85.5 |
| Redundancy | 3.6 | 3.6 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | batch | 6 | 293 | 2.4M Ammonium sulfate, 10mM TrisHCl, 100mM Sodium phosphate, pH 6.0, batch, temperature 293K |
