4H6X
Structure of Patellamide maturation protease PatG
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Detector technology | CCD |
Collection date | 2009-06-09 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 133.940, 66.919, 105.605 |
Unit cell angles | 90.00, 112.17, 90.00 |
Refinement procedure
Resolution | 25.000 - 2.000 |
R-factor | 0.2024 |
Rwork | 0.200 |
R-free | 0.24350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.166 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Rmerge | 0.080 | 0.047 | 0.443 |
Number of reflections | 56509 | ||
<I/σ(I)> | 10.4 | ||
Completeness [%] | 96.5 | 99.9 | 76.9 |
Redundancy | 7.1 | 7.5 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 281 | PEG 20000, vapor diffusion, hanging drop, temperature 281K |