5ZR2
Crystal Structure of Phosphoserine Phosphatase Mutant (H9A) from Entamoeba histolytica in complex with Phosphoserine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2017-10-20 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54178 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 95.107, 111.737, 178.246 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 89.280 - 2.950 |
R-factor | 0.20929 |
Rwork | 0.207 |
R-free | 0.24980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5zkk |
RMSD bond length | 0.007 |
RMSD bond angle | 1.241 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 89.280 | 3.000 |
High resolution limit [Å] | 2.950 | 2.950 |
Number of reflections | 19911 | 930 |
<I/σ(I)> | 11.9 | |
Completeness [%] | 97.9 | |
Redundancy | 4.8 | |
CC(1/2) | 0.910 | 0.671 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | PEG1500, MMT buffer pH 4.2, ammonium sulphate |