4N2D
Crystal structure of Protein Arginine Deiminase 2 (D123N, 0 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 |
| Detector technology | CCD |
| Collection date | 2003-01-01 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.9787 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 202.190, 51.820, 75.895 |
| Unit cell angles | 90.00, 105.66, 90.00 |
Refinement procedure
| Resolution | 36.248 - 2.000 |
| R-factor | 0.1801 |
| Rwork | 0.178 |
| R-free | 0.22350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4n20 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.312 |
| 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] | 36.248 | |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.075 | 0.466 |
| Number of reflections | 52659 | |
| <I/σ(I)> | 16.7 | 2.5 |
| Completeness [%] | 99.9 | |
| Redundancy | 3.7 |
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 |
