3E7P
CRYSTAL STRUCTURE OF of putative methyltransferase from Bacteroides vulgatus ATCC 8482
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 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 55.702, 103.568, 132.809 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.470 - 1.900 |
R-factor | 0.186 |
Rwork | 0.184 |
R-free | 0.21700 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.393 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | RESOLVE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.960 |
High resolution limit [Å] | 1.890 | 4.070 | 1.890 |
Rmerge | 0.053 | 0.033 | 0.285 |
Number of reflections | 44798 | ||
Completeness [%] | 75.1 | 98.5 | 23.5 |
Redundancy | 3.5 | 3.7 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 294 | 0.1M Bis-Tris, 45% PPG P400, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 294K |