4ZZT
Geotrichum candidum Cel7A structure complex with thio-linked cellotriose at 1.56A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-07 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.470, 80.760, 55.060 |
| Unit cell angles | 90.00, 109.60, 90.00 |
Refinement procedure
| Resolution | 51.870 - 1.560 |
| R-factor | 0.15771 |
| Rwork | 0.156 |
| R-free | 0.18355 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gpi |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.178 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | CCP4 |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.870 | 1.590 |
| High resolution limit [Å] | 1.560 | 1.560 |
| Rmerge | 0.060 | 0.220 |
| Number of reflections | 48793 | |
| <I/σ(I)> | 10.5 | 4 |
| Completeness [%] | 97.8 | 97.8 |
| Redundancy | 3.9 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.9 | 0.2M MAGNESIUM CHLORIDE HEXAHYDRATE, 20% PEG 3350, pH 5.9 |
