5CVY
The Structure of Bacillus pumilus GH48 in complex with cellobiose and cellohexaose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-05-06 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.54188 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 98.041, 98.041, 218.956 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.000 |
| R-factor | 0.14787 |
| Rwork | 0.146 |
| R-free | 0.18880 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g9g |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.849 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.100 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.123 | 0.438 |
| Number of reflections | 72223 | |
| <I/σ(I)> | 14.8 | 3.55 |
| Completeness [%] | 99.0 | 93.8 |
| Redundancy | 7.63 | 4.71 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 2-3 M sodium malonate, pH 5.0-7.0, 20 mM cellobiose |
