7DUD
Crystal Structure of erWalK
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-12-15 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.9891 |
| Spacegroup name | P 32 |
| Unit cell lengths | 66.630, 66.630, 80.083 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 21.040 - 1.950 |
| R-factor | 0.2263 |
| Rwork | 0.225 |
| R-free | 0.24830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ywz |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.208 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (1.18.1_3865) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.096 | 0.573 |
| Rpim | 0.033 | 0.184 |
| Number of reflections | 28906 | 1412 |
| <I/σ(I)> | 23.9 | 2.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.2 | 9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 Ammonium citrate, 18 % w/v PEG 3350 |
