5Z4T
Complex structure - AxMan113A-M3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-06-12 |
| Detector | RAYONIX MX225-HS |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 65.095, 69.918, 186.601 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.920 - 1.680 |
| R-factor | 0.1854 |
| Rwork | 0.185 |
| R-free | 0.21040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ylh |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX (dev-2474) |
| Refinement software | PHENIX (dev-2474) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.920 | 1.740 |
| High resolution limit [Å] | 1.680 | 1.680 |
| Rmerge | 0.198 | |
| Number of reflections | 91072 | 91702 |
| <I/σ(I)> | 6.8 | |
| Completeness [%] | 93.0 | 93 |
| Redundancy | 9.3 | |
| CC(1/2) | 0.976 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | HEPES sodium pH 7.5, 2-Propanol, PEG 4000 |
