3DR3
Structure of IDP00107, a potential N-acetyl-gamma-glutamylphosphate reductase from Shigella flexneri
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-04-22 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 117.299, 117.299, 115.472 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 24.810 - 2.000 |
| R-factor | 0.16838 |
| Rwork | 0.166 |
| R-free | 0.21623 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | protein atoms from 2G17 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.549 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.108 | 0.454 |
| Number of reflections | 32186 | |
| <I/σ(I)> | 31.4 | 10.1 |
| Completeness [%] | 99.7 | 99.3 |
| Redundancy | 16.8 | 16 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 2.2 M D,L-Malic Acid and 0.1 M Bis-Tris Propane. Cryoprotected with N-paratone oil, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
