9KNF
Crystal structure of human ERRg LBD in complex with 4028691
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-01-09 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97875 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 64.200, 64.200, 138.870 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 58.270 - 1.620 |
| R-factor | 0.17491 |
| Rwork | 0.172 |
| R-free | 0.22770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.804 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.200 | 1.640 |
| High resolution limit [Å] | 1.620 | 1.620 |
| Rmerge | 0.096 | 1.292 |
| Rmeas | 0.098 | 1.318 |
| Rpim | 0.020 | 0.261 |
| Total number of observations | 820062 | 45703 |
| Number of reflections | 34901 | 1866 |
| <I/σ(I)> | 21.4 | 2.9 |
| Completeness [%] | 91.7 | |
| Redundancy | 23.5 | 24.5 |
| CC(1/2) | 0.999 | 0.815 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.0 M K/Na tartrate, 0.1 M Tris pH 7.0, 0.2 M Li2SO4 |
