5XMW
Selenomethionine-derivated ZHD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | AREA DETECTOR |
| Collection date | 2014-09-07 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97869 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.924, 90.169, 113.056 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.010 - 3.000 |
| R-factor | 0.20913 |
| Rwork | 0.208 |
| R-free | 0.23585 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.343 |
| Data reduction software | HKL-2000 (v1.0) |
| Data scaling software | HKL-2000 (v1.0) |
| Phasing software | PHENIX (v 1.9) |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.010 | 3.076 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.131 | 0.512 |
| Rpim | 0.038 | 0.139 |
| Number of reflections | 14839 | 1072 |
| <I/σ(I)> | 9.31 | |
| Completeness [%] | 99.6 | 98.3 |
| Redundancy | 13.6 | 14.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | 1.2 M AMMONIUM DIBASIC PHOSPHATE, 200 MM KCL, 100 MM IMIDAZOLE |
