3UI5
Crystal structure of human Parvulin 14
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-08-13 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 34.170, 47.060, 51.830 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.840 - 1.400 |
| R-factor | 0.0983 |
| Rwork | 0.096 |
| R-free | 0.13650 |
| RMSD bond length | 0.023 |
| RMSD bond angle | 2.402 |
| Data scaling software | XSCALE |
| Refinement software | REFMAC (5.6.0077) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 34.840 | 34.840 | 1.500 |
| High resolution limit [Å] | 1.400 | 30.000 | 1.400 |
| Rmerge | 0.052 | 1.105 | 0.100 |
| Number of reflections | 16763 | 1 | 2926 |
| <I/σ(I)> | 82.35 | 49.66 | |
| Completeness [%] | 98.3 | 100 | 93.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8 | 298 | 0.1 M Tris, 2.5 M (NH4)2SO4, 3-20 mM Ala-Pro, pH 8.0, vapor diffusion, temperature 298K |
