1W2I
Crystal structuore of acylphosphatase from Pyrococcus horikoshii complexed with formate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.1 |
Synchrotron site | SRS |
Beamline | PX14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-05-24 |
Detector | ADSC CCD |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 85.336, 85.336, 75.650 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 73.920 - 1.500 |
R-factor | 0.167 |
Rwork | 0.166 |
R-free | 0.17400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2acy |
RMSD bond length | 0.009 |
RMSD bond angle | 1.199 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 16.950 | 1.580 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.080 | 0.390 |
Number of reflections | 51268 | |
<I/σ(I)> | 22.5 | 5.2 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 9.7 | 9.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 290 | 0.1M MES PH6 1.4M SODIUM FORMATE 17C, pH 6.00 |