1NUH
The crystal structure of human phosphoglucose isomerase complexed with 5-phosphoarabinonate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2000-12-15 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 94.400, 94.400, 137.100 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.500 * |
| R-factor | 0.217 |
| Rwork | 0.214 |
| R-free | 0.26800 |
| Structure solution method | REFINEMENT |
| Starting model (for MR) | PDN ENTRY 1IAT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.480 * |
| Data reduction software | CrystalClear ((MSC/RIGAKU)) |
| Data scaling software | CrystalClear ((MSC/RIGAKU)) |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 * | 2.590 |
| High resolution limit [Å] | 2.500 * | 2.500 * |
| Rmerge | 0.128 | 0.254 |
| Number of reflections | 21797 | |
| <I/σ(I)> | 5.7 | 3.1 |
| Completeness [%] | 98.4 | 99.8 |
| Redundancy | 6.9 | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 * | 294 | Read, J., (2001) J.Mol.Biol., 309, 447. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | ammonium sulfate | 2.6 (M) | |
| 2 | 1 | reservoir | Tris | 100 (mM) | |
| 3 | 1 | drop | HEPES | 15 (mM) | |
| 4 | 1 | drop | beta-mercaptoethanol | 2 (mM) | |
| 5 | 1 | drop | protein | 4 (mg/ml) |
