7DUC
Crystal Structure of cyto WalK
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 | 2020-11-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9791 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 53.725, 60.201, 81.306 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.100 - 2.560 |
| R-factor | 0.197 |
| Rwork | 0.195 |
| R-free | 0.24040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4mn5 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.334 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.1_3865) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.590 |
| High resolution limit [Å] | 2.550 | 2.550 |
| Rmerge | 0.088 | 0.650 |
| Rpim | 0.032 | 0.291 |
| Number of reflections | 8992 | 437 |
| <I/σ(I)> | 25.4 | 2.5 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 11.1 | 8.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 8 mmol Zinc Chloride, 16 % w/v PEG 3350, 0.1 M TRIS pH 8.5 |
