4AIU
A complex structure of BtGH84
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 | 2009-11-28 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 185.550, 52.030, 85.900 |
| Unit cell angles | 90.00, 99.79, 90.00 |
Refinement procedure
| Resolution | 45.710 - 2.250 |
| R-factor | 0.19804 |
| Rwork | 0.195 |
| R-free | 0.24672 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cho |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.762 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.6.0086) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.440 | 2.370 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmerge | 0.070 | 0.470 |
| Number of reflections | 38450 | |
| <I/σ(I)> | 11 | 2.6 |
| Completeness [%] | 99.2 | 98.5 |
| Redundancy | 3.6 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2 M SODIUM MALONATE, 0.1 M BIS-TRIS PH8.0, 22 % PEG3350 (W/V) |
