2BH0
Crystal structure of a SeMet derivative of EXPA from Bacillus subtilis at 2.5 angstrom
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-11-06 |
Detector | MARRESEARCH |
Spacegroup name | I 2 3 |
Unit cell lengths | 144.035, 144.035, 144.035 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.460 - 2.500 |
R-factor | 0.203 |
Rwork | 0.203 |
R-free | 0.23100 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | MOSFLM |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.460 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.130 | 0.680 |
Number of reflections | 17348 | |
<I/σ(I)> | 31.6 | 5.1 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 21.8 | 21.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4M NAFORMATE |