Table 1.
Sample | NCX2-CBD12 | NCX2-CBD12-AC | NCX2-CBD12-B | |||
---|---|---|---|---|---|---|
Ligand | 10 mM Ca2+ | 10 mM EDTA | 10 mM Ca2+ | 10 mM EDTA | 10 mM Ca2+ | 10 mM EDTA |
Data collection parameters | ||||||
Beamline | ESRF BM29 | |||||
Beam geometry (mm2) | 0.5 × 0.5 | |||||
Wavelength (Å) | 1.0 | |||||
Q range (Å−1) | 0.0025–0.5 | |||||
Exposure time per frame (seconds)1 | 1 | |||||
Concentration range (mg/ml) | 1.5–10 | 1.5–11.5 | 1.5–11.25 | |||
Temperature (°C) | 5 | |||||
Structural parameters | ||||||
Rg (Å) [from P(r)]2 | 34.9 ± 0.01 | 32.5 ± 0.007 | 33.9 ± 0.006 | 35.0 ± 0.01 | 34.1 ± 0.007 | 33.5 ± 0.01 |
Rg (Å) (from Guinier)2 | 32.6 ± 0.1 | 31.5 ± 0.2 | 32 ± 0.1 | 36.2 ± 0.4 | 32.9 ± 0.1 | 33.5 ± 0.3 |
Dmax (Å)3 | 120 ± 12 | 108 ± 11 | 115 ± 12 | 120 ± 12 | 115 ± 12 | 120 ± 12 |
Porod volume [from P(r)] (103 Å3) | 45.9 | 70.0 | 39.5 | 72.5 | 40.5 | 56.3 |
NSD4 | 0.85 ± 0.04 | NA | 0.81 ± 0.05 | NA | 0.81 ± 0.05 | NA |
χ2 (EOM) | 1.5 | NA | 0.65 | NA | 0.66 | NA |
Software employed | ||||||
Primary data reduction | AUTOMAR | |||||
Data processing | PRIMUS | |||||
Modelling | DAMMIF, EOM |
1Ten frames were measured for each sample. 2±S.E. 3±10% (estimated range). 4NSD, normalized shape discrepancy for DAMMIF calculation.