2XZT
Caspase-3 in Complex with DARPin-3.4_I78S
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 90 |
Detector technology | PIXEL |
Collection date | 2010-10-12 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 98.000, 98.000, 193.600 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.000 - 2.700 |
R-factor | 0.19853 |
Rwork | 0.197 |
R-free | 0.23051 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2dko |
RMSD bond length | 0.006 |
RMSD bond angle | 0.884 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.070 | 0.600 |
Number of reflections | 30248 | |
<I/σ(I)> | 15.55 | 2.66 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 4.4 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.8 | 100 MM HEPES, PH 7.8 (RT) 70 % 2-METHYL-2,4-PENTANEDIOL |