2BLV
Trypsin before a high dose x-ray "burn"
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-12-18 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.162, 58.253, 66.582 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 1.200 |
R-factor | 0.107 |
Rwork | 0.106 |
R-free | 0.12800 |
Structure solution method | OTHER |
RMSD bond length | 0.013 |
RMSD bond angle | 1.625 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELXD |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.300 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.050 | 0.120 |
Number of reflections | 122171 | |
<I/σ(I)> | 12.46 | 6.47 |
Completeness [%] | 96.0 | 93.5 |
Redundancy | 2.1 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |