4BMX
Native structure of futalosine hydrolase of Helicobacter pylori strain 26695
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 59.314, 90.573, 108.381 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.249 - 1.760 |
| R-factor | 0.171 |
| Rwork | 0.169 |
| R-free | 0.21180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nm4 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.986 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.190 | 1.790 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.130 | 0.930 |
| Number of reflections | 57414 | |
| <I/σ(I)> | 15.8 | 2.2 |
| Completeness [%] | 98.0 | 96.9 |
| Redundancy | 10.1 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | PROTEIN WAS CRYSTALLIZED IN 4.0 M NA/K PHOSPHATE |
