8OMM
Coproporphyrin III - LmCpfC complex soaked 3min with Fe2+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-03-05 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 1.7 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.158, 67.730, 62.494 |
| Unit cell angles | 90.00, 103.22, 90.00 |
Refinement procedure
| Resolution | 36.170 - 2.150 |
| Rwork | 0.182 |
| R-free | 0.23290 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.516 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.260 | 2.080 |
| High resolution limit [Å] | 2.010 | 2.010 |
| Number of reflections | 32898 | 1808 |
| <I/σ(I)> | 7.8 | |
| Completeness [%] | 99.1 | |
| Redundancy | 6.5 | |
| CC(1/2) | 0.997 | 0.997 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | 293 | 17.455% PEG MME2000 0.2M Ca-Acetate 0.1M BIS-TRIS pH 6.3 |
