4BP0
Crystal structure of the closed form of Pseudomonas aeruginosa SPM-1
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 |
Collection date | 2012-12-11 |
Detector | DECTRIS PILATUS |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.650, 83.550, 282.410 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 71.943 - 2.240 |
R-factor | 0.1533 |
Rwork | 0.152 |
R-free | 0.19810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fhx |
RMSD bond length | 0.014 |
RMSD bond angle | 1.174 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 71.910 | 2.300 |
High resolution limit [Å] | 2.240 | 2.240 |
Rmerge | 0.080 | 0.760 |
Number of reflections | 53352 | |
<I/σ(I)> | 15.7 | 3 |
Completeness [%] | 99.9 | 100 |
Redundancy | 6.4 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | PROTEIN WAS CRYTALLISED FROM 10% W/V POLYETHYLENE GLYCOL 8000, 0.1M HEPES, PH7.5, VAPOR DIFFUSION SITTING DROP, ROOM TEMPERATURE |