7D54
Crstal structure MsGATase with Gln
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 | 2018-12-08 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97853 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.376, 72.494, 69.529 |
| Unit cell angles | 90.00, 111.37, 90.00 |
Refinement procedure
| Resolution | 36.250 - 1.850 |
| R-factor | 0.1939 |
| Rwork | 0.192 |
| R-free | 0.23550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1o1y |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.191 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.880 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rpim | 0.068 | 0.334 |
| Number of reflections | 54049 | 2708 |
| <I/σ(I)> | 18.7 | 2.1 |
| Completeness [%] | 98.8 | 99.8 |
| Redundancy | 3.1 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | 0.1M HEPES pH 7.5, 2.0M Ammonium sulfate. |
