4ZZU
Geotrichum candidum Cel7A structure complex with thio-linked cellotetraose at 1.4A
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 |
| Collection date | 2013-10-24 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.710, 90.520, 55.090 |
| Unit cell angles | 90.00, 109.62, 90.00 |
Refinement procedure
| Resolution | 51.890 - 1.440 |
| R-factor | 0.15112 |
| Rwork | 0.150 |
| R-free | 0.16716 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gpi |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.150 |
| 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] | 27.620 | 1.470 |
| High resolution limit [Å] | 1.440 | 1.440 |
| Rmerge | 0.050 | 0.220 |
| Number of reflections | 70235 | |
| <I/σ(I)> | 13.7 | 4.4 |
| Completeness [%] | 99.5 | 97.9 |
| Redundancy | 3.1 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.9 | 0.2M MAGNESIUM CHLORIDE HEXAHYDRATE, 20% PEG 3350, pH 5.9 |
