4BN0
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 | P 1 21 1 |
Unit cell lengths | 64.230, 75.690, 97.010 |
Unit cell angles | 90.00, 106.38, 90.00 |
Refinement procedure
Resolution | 39.674 - 2.110 |
R-factor | 0.212 |
Rwork | 0.209 |
R-free | 0.26140 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4bmx |
RMSD bond length | 0.016 |
RMSD bond angle | 1.718 |
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] | 39.640 | 2.170 |
High resolution limit [Å] | 2.110 | 2.110 |
Rmerge | 0.130 | 0.460 |
Number of reflections | 48788 | |
<I/σ(I)> | 4.9 | 2.1 |
Completeness [%] | 95.1 | 98 |
Redundancy | 3.5 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.1 M HEPES PH 7.5, 25% PEG-3350, 0.2 M NACL |