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 |
