Table 1.
SidJ:CaM:SdeA (EMD-23862) (PDBID: 7MIR) | SidJ:CaM:SdeC (EMD-23863) (PDBID: 7MIS) | |
---|---|---|
Data collection and processing | ||
Magnification | 81,000 | 81,000 |
Voltage (kV) | 300 | 300 |
Electron exposure (e−/Å−2) | 50 | 50 |
Defocus range (μm) | 0.8 – 2.5 | 0.8 – 2.5 |
Pixel size (Å) | 1.08 | 1.08 |
Symmetry imposed | C1 | C1 |
Initial particle images (no.) | 3,193,233 | 4,454,035 |
Final particle images (no.) | 310,154 | 152,589 |
Map resolution (Å) | 2.5 | 2.8 |
FSC threshold | 0.143 | 0.143 |
Refinement | ||
Initial model used (PDB code) | 5YIM, 6S5T | SidJ-SdeA |
Model resolution (Å) | 2.6 | 2.9 |
FSC threshold | 0.5 | 0.5 |
Map sharpening B factor (Å−2) | −37 | −47 |
Model composition | ||
Nonhydrogen atoms | 12,997 | 13,039 |
Protein residues | 1,603 | 1,616 |
Ligands | 5 | 6 |
B factors (Å−2) | ||
Protein | 48.5 | 54.9 |
Ligands | 36.9 | 30.8 |
R.m.s. deviations | ||
Bond lengths (Å) | 0.003 | 0.003 |
Bond angles (°) | 0.485 | 0.468 |
Validation | ||
MolProbity score | 1.27 | 1.42 |
Clashscore | 2.83 | 3.74 |
Poor rotamers (%) | 0 | 0 |
Ramachandran plot | ||
Favored (%) | 96.8 | 96.2 |
Allowed (%) | 3.2 | 3.8 |
Disallowed (%) | 0 | 0 |