3ED9
Carbonmonoxy Sperm Whale Myoglobin at 140 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] | 140 |
| Detector technology | CCD |
| Collection date | 2008-02-20 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.827 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.347, 30.620, 63.799 |
| Unit cell angles | 90.00, 105.87, 90.00 |
Refinement procedure
| Resolution | 16.750 - 1.210 |
| R-factor | 0.17 |
| Rwork | 0.167 |
| R-free | 0.22000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mbc |
| RMSD bond length | 0.035 |
| RMSD bond angle | 2.971 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| 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 | 0.053 | 0.023 | 0.533 |
| Number of reflections | 35228 | ||
| <I/σ(I)> | 8.6 | ||
| Completeness [%] | 88.9 | 98.2 | 35 |
| Redundancy | 3.4 | 3.6 | 1.6 |
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 |
