2BJV
Crystal Structure of PspF(1-275) R168A mutant
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-09-28 |
Detector | ADSC |
Wavelength(s) | 0.97, 1.1 |
Spacegroup name | P 65 |
Unit cell lengths | 113.613, 113.613, 39.145 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.000 - 1.700 |
R-factor | 0.17235 |
Rwork | 0.172 |
R-free | 0.21244 |
Structure solution method | MAD |
RMSD bond length | 0.019 |
RMSD bond angle | 1.600 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHARP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.000 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.044 | 0.277 |
Number of reflections | 29411 | |
<I/σ(I)> | 26 | 3 |
Completeness [%] | 91.6 | 60.5 |
Redundancy | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 2 M AMMONIUM FORMATE, 0.1 MM HEPES PH 8.0, 10% MPD |