4DNM
Crystal structure of an amidohydrolase (cog3618) from burkholderia multivorans (target efi-500235) with bound hepes, space group p3221
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-15 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 75.070, 75.070, 142.260 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.988 - 2.150 |
R-factor | 0.1921 |
Rwork | 0.190 |
R-free | 0.22790 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.110 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 2.030 | |
High resolution limit [Å] | 1.930 | 1.930 |
Rmerge | 0.124 | 1.984 |
Number of reflections | 35866 | |
<I/σ(I)> | 13 | 1.4 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 11.4 | 11.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | sitting drop vapor diffuction | 7.5 | 298 | Protein (10 mM Hepes, pH 7.8, 150 mM NaCl, 10% glycerol, 0.5 mM ZnCl, 0.5 mM Fuconate 1,4-lactone; Reservoir (20% Peg3350, 100 mM HEPES pH 7.5, 9 mM TCEP); Cryoprotection (Reservoir, + 20% glycerol), sitting drop vapor diffuction, temperature 298K |