Table 1 X-ray data collection and refinement statistics.
From: Enantiomer-specific activities of an LRH-1 and SF-1 dual agonist
Data collection | LRH-1/SS-RJW100 /Tif2 |
|---|---|
Space group | P43212 |
Cell dimensions | |
a, b, c (Å) | 46.6 46.6, 220.9 |
α,β,γ (°) | 90, 90, 90 |
Resolution (Å) | 50–1.70 (1.76–1.70)* |
Rpim | 0.04 (0.29) |
I/σI | 18.2 (1.75) |
CC1/2 | (0.788) |
Completeness (%) | 97.4 (84.9) |
Redundancy | 3.8 (2.4) |
Refinement | |
Resolution (Å) | 1.70 |
No. reflections | 48,242 |
Rwork/Rfree (%) | 21.1 / 22.8 |
No. atoms | |
Protein | 2041 |
Water | 106 |
B-factors | |
Protein | 37.7 |
Ligand | 61.5 |
Water | 43.3 |
R.m.s. deviations | |
Bond lengths (Å) | 0.003 |
Bond angles (°) | 0.571 |
Ramachandran favoured (%) | 99 |
Ramachandran outliers (%) | 0 |
PDB accession code | 6VC2 |
