2I6P
Crystal structure of the complex of the archaeal sulfolobus PTP-fold phosphatase with pNPP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 298 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-08-01 |
| Detector | RIGAKU RAXIS IV |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.200, 57.652, 42.517 |
| Unit cell angles | 90.00, 92.87, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.500 |
| Rwork | 0.224 |
| R-free | 0.28400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ohe |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.345 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.077 | 0.319 |
| Number of reflections | 4664 | |
| <I/σ(I)> | 17.6 | 2.77 |
| Completeness [%] | 80.6 | 91.7 |
| Redundancy | 2.8 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
