5WH8
Cellulase Cel5C_n
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 150 |
| Detector technology | CCD |
| Collection date | 2016-06-10 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.210, 75.500, 88.830 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 27.566 - 1.570 |
| R-factor | 0.146 |
| Rwork | 0.145 |
| R-free | 0.17400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3pzt |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.347 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.570 | 1.626 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Rmerge | 0.070 | 0.816 |
| Number of reflections | 46380 | 4564 |
| <I/σ(I)> | 19.1 | 3.02 |
| Completeness [%] | 98.8 | 99 |
| Redundancy | 5.9 | 5.8 |
| CC(1/2) | 0.854 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.09M NaF, 0.09M NaBr, 0.09 M NaI, 0.1 M imidazole, MES monohydrate pH 6.5, 20% PEG 500 MME, 20% PEG 20K |
