2GMN
Crystal structure of BJP-1, a subclass B3 metallo-beta-lactamase of Bradyrhizobium japonicum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-11-30 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.281302 |
Spacegroup name | P 1 |
Unit cell lengths | 42.501, 44.773, 76.966 |
Unit cell angles | 78.92, 89.51, 61.91 |
Refinement procedure
Resolution | 38.580 - 1.400 |
R-factor | 0.1797 |
Rwork | 0.176 |
R-free | 0.21322 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.163 |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | SHELXD |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.576 | 1.480 |
High resolution limit [Å] | 1.400 | 1.400 |
Number of reflections | 87661 | |
Completeness [%] | 91.0 | 77.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 0.1M Tris, 0.4M Na acetate, 40% PEG4000, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |