8PHB
Crystal structure of apo Cami1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P14 (MX2) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-12-07 |
| Detector | DECTRIS EIGER2 R 1M |
| Wavelength(s) | 0.9686 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 65.238, 90.428, 65.616 |
| Unit cell angles | 90.00, 99.56, 90.00 |
Refinement procedure
| Resolution | 64.710 - 1.700 |
| R-factor | 0.1887 |
| Rwork | 0.186 |
| R-free | 0.21470 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.830 |
| Data reduction software | XDS (Mar 15, 2019) |
| Data scaling software | SCALA (3.3.20) |
| Phasing software | SHELX |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.710 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.042 | 0.669 |
| Rmeas | 0.049 | 0.784 |
| Rpim | 0.018 | 0.292 |
| Total number of observations | 578268 | 83153 |
| Number of reflections | 81871 | 11877 |
| <I/σ(I)> | 17.7 | 2.5 |
| Completeness [%] | 99.3 | |
| Redundancy | 7.1 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 292 | 0.02 M carboxylic acids, 0.1 M MOPS/HEPES pH 7.5, 10% PEG 20K, 10% PEG400 |
