1CC3
PURPLE CUA CENTER
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 123 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-09-11 |
| Detector | RIGAKU |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 35.630, 62.332, 51.230 |
| Unit cell angles | 90.00, 99.50, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.650 |
| R-factor | 0.189 * |
| Rwork | 0.201 |
| R-free | 0.26300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4azu |
| RMSD bond length | 0.009 |
| RMSD bond angle | 2.476 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | X-PLOR |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.750 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.105 | 0.760 |
| Number of reflections | 26467 | |
| <I/σ(I)> | 17 | 3.3 |
| Completeness [%] | 97.8 * | 96.4 |
| Redundancy | 3 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 5.1 | 5 * | pH 5.1 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 11.5 (mg/ml) | |
| 2 | 1 | drop | ammonium acetate | 125 (mM) | pH5.1 |
| 3 | 1 | drop | sodium acetate | 0.05 (M) | pH4.6 |
| 4 | 1 | drop | PEG2000 | 15 (%) | |
| 5 | 1 | reservoir | ammonium acetate | 0.2 (M) | |
| 6 | 1 | reservoir | sodium acetate | 0.1 (M) | pH4.6 |
| 7 | 1 | reservoir | PEG4000 | 20 (%) |
