2IHP
Yeast inorganic pyrophosphatase with magnesium and phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM1A |
Synchrotron site | ESRF |
Beamline | BM1A |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2001-02-06 |
Detector | MARRESEARCH |
Wavelength(s) | 0.8727 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.915, 93.549, 69.168 |
Unit cell angles | 90.00, 99.66, 90.00 |
Refinement procedure
Resolution | 19.920 - 1.500 |
R-factor | 0.163 |
Rwork | 0.162 |
R-free | 0.18000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1huk |
RMSD bond length | 0.011 |
RMSD bond angle | 1.445 |
Data reduction software | DENZO |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.041 | 0.321 |
Number of reflections | 103964 | |
<I/σ(I)> | 21.7 | 3.2 |
Completeness [%] | 99.8 | 100 |
Redundancy | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6 | 277 | 16% MPD, 10 mM MgCl2, 1 mM PO4-, pH 6.0, VAPOR DIFFUSION, temperature 277K |