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 |