9WTU
Crystal structure of HrmI in complex with the diferrous iron and lysine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER D8 QUEST |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-07-17 |
| Detector | Bruker PHOTON II |
| Wavelength(s) | 1.542 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 112.750, 112.750, 68.487 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 25.200 - 2.000 |
| R-factor | 0.15457 |
| Rwork | 0.153 |
| R-free | 0.18872 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.865 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.200 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.084 | 0.420 |
| Rmeas | 0.094 | 0.487 |
| Rpim | 0.042 | 0.244 |
| Number of reflections | 34210 | 1684 |
| <I/σ(I)> | 4.3 | 9.9 |
| Completeness [%] | 99.8 | |
| Redundancy | 4.9 | |
| CC(1/2) | 0.990 | 0.816 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | HEPES, potassium sodium tartrate |
