3RJN
Horse heart myoglobin: D44K/D60K mutant with zinc (II) -deuteroporphyrin dimethyl ester
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 110 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-07-13 |
| Detector | MAR scanner 300 mm plate |
| Wavelength(s) | 0.97856 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.814, 30.537, 56.674 |
| Unit cell angles | 90.00, 97.64, 90.00 |
Refinement procedure
| Resolution | 56.170 - 1.900 |
| R-factor | 0.17743 |
| Rwork | 0.175 |
| R-free | 0.22769 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.024 |
| RMSD bond angle | 3.907 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.170 | 1.948 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 11154 | |
| Completeness [%] | 99.7 | 98.84 |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 3.3 M ammonium sulfate, 0.1 M TRIS, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
