4AVR
Crystal structure of the hypothetical protein Pa4485 from Pseudomonas aeruginosa
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 1 |
Unit cell lengths | 33.978, 39.020, 41.870 |
Unit cell angles | 102.80, 103.48, 115.54 |
Refinement procedure
Resolution | 37.870 - 1.080 |
R-factor | 0.15015 |
Rwork | 0.149 |
R-free | 0.17747 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.009 |
RMSD bond angle | 1.531 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | SHELX |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.100 |
High resolution limit [Å] | 1.080 | 1.080 |
Rmerge | 0.060 | 0.170 |
Number of reflections | 65937 | |
<I/σ(I)> | 38.7 | 9.1 |
Completeness [%] | 92.1 | 88.8 |
Redundancy | 4.1 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.5 | 25% PEG 3350, 0.2M NACL AND 0.1M BIS-TRIS PH 5.5 |