4BMY
Structure of futalosine hydrolase mutant of Helicobacter pylori strain 26695
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 54.849, 123.414, 145.853 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.890 - 1.650 |
R-factor | 0.17068 |
Rwork | 0.169 |
R-free | 0.20056 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4bmx |
RMSD bond length | 0.019 |
RMSD bond angle | 1.950 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.830 | 1.680 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.080 | 0.860 |
Number of reflections | 59812 | |
<I/σ(I)> | 16.9 | 2.1 |
Completeness [%] | 99.9 | 99.6 |
Redundancy | 8.2 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.1 M BIS-TRIS PH 6.5, 25% PEG-3350, 0.2 M LI2SO4.H2O |