4V2O
Structure of saposin B in complex with chloroquine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-04-30 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 75.299, 75.299, 94.716 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 15.000 - 2.130 |
R-factor | 0.2303 |
Rwork | 0.229 |
R-free | 0.25380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1n69 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.080 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | BUSTER (2.10.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.000 | 2.200 |
High resolution limit [Å] | 2.130 | 2.130 |
Rmerge | 0.080 | 1.000 |
Number of reflections | 17890 | |
<I/σ(I)> | 14.4 | 1.6 |
Completeness [%] | 98.9 | 92.5 |
Redundancy | 6.9 | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1M MES, PH 6.0, 30% PEG6000 |