1DXD
Photolyzed CO complex of Myoglobin Mb-YQR at 20K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 20 |
| Detector technology | CCD |
| Collection date | 1998-05-15 |
| Detector | BRANDEIS |
| Spacegroup name | P 6 |
| Unit cell lengths | 90.493, 90.493, 45.283 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 18.000 - 1.400 |
| Rwork | 0.133 |
| R-free | 0.16900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 0.031 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.500 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.036 * | 0.111 * |
| Total number of observations | 41213 * | |
| Number of reflections | 7686 * | |
| <I/σ(I)> | 19.8 | 3.6 |
| Completeness [%] | 98.5 | 99.1 |
| Redundancy | 3.3 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 8.7 * | 21 * | drop consists of equal volume of protein and reservoir solutions * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 1 (mM) | |
| 2 | 1 | reservoir | ammonium sulfate | 2.7 (M) | |
| 3 | 1 | reservoir | Tris-HCl | 20 (mM) | |
| 4 | 1 | reservoir | EDTA | 1 (mM) |
