4N2N
Crystal structure of Protein Arginine Deiminase 2 (E354A, 10 mM Ca2+)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-01-01 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.9787 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 203.200, 51.630, 76.540 |
Unit cell angles | 90.00, 106.04, 90.00 |
Refinement procedure
Resolution | 38.063 - 1.800 |
R-factor | 0.1711 |
Rwork | 0.169 |
R-free | 0.20120 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4n25 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.237 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.7.2_869) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.063 | |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.094 | 0.536 |
Number of reflections | 70612 | |
<I/σ(I)> | 2.3 | |
Completeness [%] | 99.5 | 99 |
Redundancy | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 10-20% MPD, 50 mM MES, pH 5.6, 0.12 M sodium acetate, VAPOR DIFFUSION, SITTING DROP |