5ERT
GephE in complex with Mn(2+) - ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-3 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-3 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-04-23 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.9640 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 87.440, 99.090, 111.895 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.558 - 2.000 |
| R-factor | 0.1766 |
| Rwork | 0.175 |
| R-free | 0.20530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4pd0 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.994 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.960 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.195 | 1.589 |
| Number of reflections | 33205 | |
| <I/σ(I)> | 11.6 | 1.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 12.9 | 12.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 293 | 0.1 M sodium acetate, 26% MPD |
