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. 2024 Sep 6;15:7795. doi: 10.1038/s41467-024-51904-7

Table 1.

Cryo-EM data collection, refinement, and validation statistics

E2 (EMD-19167) (PDB 8RH4) GABA + E2 Primed (EMD-19171) (PDB 8RH7) GABA + E2 Desensitized (EMD-19172) (PDB 8RH8) PS (EMD-19173) (PDB 8RH9) GABA + PS (EMD-19175) (PDB 8RHG)
Data collection and processing
Magnification 130,000 130,000 130,000 130,000 130,000
Voltage (kV) 300 300 300 300 300
Electron exposure (e/Å2) 41.58 41.58 41.58 44.61 44.38
Defocus range (μm) − 0.8 to − 1.8 − 0.8 to − 1.8 − 0.8 to − 1.8 − 0.8 to − 1.8 − 0.8 to − 1.8
Pixel size (Å) 0.6725 0.6725 0.6725 0.6725 0.6725
Symmetry imposed C5 C5 C5 C1 C1
Final particles 134,816 100,833 140,148 93,154 88,968

Map resolution (Å)

FSC threshold

2.52

0.143

2.78

0.143

2.66

0.143

3.21

0.143

3.01

0.143

Map resolution range (Å) 2.3–2.7 2.6–3.0 2.5–2.9 3.0–3.8 2.9–3.7
Refinement
Initial model (PDB code) 8OQ6 8OQ6 8OP9 8OQ6 8OP9

Model resolution (Å)

FSC threshold

2.7

0.5

2.9

0.5

2.8

0.5

3.3

0.5

3.3

0.5

Map sharpening B factor (Å2) − 97.2 − 112.2 − 109.6 − 101.0 − 97.9
Model composition
 Non-hydrogen atoms 14292 13866 14067 14247 13897
 Protein residues 1660 1610 1645 1665 1650
 Ligands 62 61 42 51 26
B factors (Å2)
 Protein 25.67 34.71 41.36 88.77 94.92
 Ligand 46.63 44.83 72.40 85.43 75.75
R.m.s. deviations
 Bond lengths (Å) 0.010 0.005 0.007 0.003 0.003
 Bond angles (°) 1.261 1.105 1.265 0.628 0.501
Validation
 MolProbity score 1.10 1.47 0.94 1.38 1.28
 Clashscore 2.05 3.48 1.58 4.71 5.10
 Poor rotamers (%) 0.32 0.34 0.33 0.06 0.07
Ramachandran plot
 Favored (%) 97.38 95.28 97.85 97.26 97.98
 Allowed (%) 2.62 4.72 2.15 2.74 2.02
 Disallowed (%) 0.00 0.00 0.00 0.00 0.00