2AFC
X-Ray Crystal Structure of Protein Q8A8B0 from Bacteroides thetaiotaomicron. Northeast Structural Genomics Consortium Target BtR9.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-06-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97908 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 128.439, 36.443, 84.028 |
Unit cell angles | 90.00, 129.03, 90.00 |
Refinement procedure
Resolution | 27.610 - 2.500 |
R-factor | 0.215 |
Rwork | 0.215 |
R-free | 0.28800 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.200 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
<I/σ(I)> | 36.3 | 25.5 |
Completeness [%] | 92.4 | 96.5 |
Redundancy | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 291 | 35% PEG3350, 0.1M MES, pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 291K |