5A2U
Crystal structure of BBA68 or BbCRASP-1 from Borrelia burgdorferi strain B31
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-3 |
Synchrotron site | MAX II |
Beamline | I911-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 54.630, 54.630, 394.280 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.450 - 3.300 |
R-factor | 0.24795 |
Rwork | 0.246 |
R-free | 0.28643 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1w33 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.998 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.330 | 3.480 |
High resolution limit [Å] | 3.300 | 3.300 |
Rmerge | 0.040 | 0.160 |
Number of reflections | 9488 | |
<I/σ(I)> | 9.9 | 3.3 |
Completeness [%] | 96.9 | 98.5 |
Redundancy | 4.2 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 10% PEG 10 000 0.1M TRIS PH 8.0 |