Table 1 X-ray data and statistics
From: Polarisome scaffolder Spa2-mediated macromolecular condensation of Aip5 for actin polymerization
Selenomethionine derivative | ||||
|---|---|---|---|---|
Aip5-C | MADInflection | MADRemote | Aip5-C-3m | |
Data collection | ||||
Wavelength (Å) | 1.000 | 0.9788 | 0.9636 | 1.5418 |
Space group | P 21 | P 21 | P 21 | P 21 21 21 |
Cell dimensions | ||||
a, b, c (Å) | 32.573, 82.775, 34.278 | 32.514, 82.471, 34.226 | 32.515, 82.465, 34.225 | 38.942, 54.596, 128.652 |
α, β, γ (°) | 90, 107.367, 90 | 90, 107.466, 90 | 90, 107.464, 90 | 90, 90, 90 |
Resolution (Å) | 50.0–2.0 (2.10–2.0) | 50.0–2.5 (2.60–2.50) | 50.0–2.5 (2.60–2.50) | 50.0–2.2 (2.30–2.20) |
No. of unique reflections | 11,332 | 5823 | 5830 | 14,417 |
Rsym (%) | 5.2 (14.2) | 5.3 (10.7) | 5.1 (10.3) | 11.1 (63.9) |
I/σI | 19.4 (7.8) | 16.4 (7.6) | 14.6 (7.6) | 14 (2.3) |
Completeness (%) | 96.8 (89.1) | 97.0 (98.3) | 97.0 (98.6) | 98.3 (99.0) |
Redundancy | 3.8 (3.4) | 2.4 (2.4) | 2.4 (2.4) | 4.9 (3.8) |
Refinement | ||||
Resolution (Å) | 32.7–2.0 | 37.3–2.2 | ||
Rwork/Rfree (%) | 22.6/26.2 | 19.7/24.6 | ||
No. of reflections | 11,303 | 14,179 | ||
No. of atoms | 1548 | 1632 | ||
Protein | 1480 | 1606 | ||
Ligand/ion | — | 26 | ||
Water | 68 | 90 | ||
B-factors | 28.2 | 34.44 | ||
Protein | 27.9 | 34.0 | ||
Ligand/ion | — | 37.1 | ||
Water | 32.8 | 42.6 | ||
RMSD | ||||
Bond lengths (Å) | 0.007 | 0.008 | ||
Bond angles (°) | 1.17 | 1.12 | ||
Ramachandran | ||||
Favored (%) | 95.45 | 97.85 | ||
Allowed (%) | 4.55 | 2.15 | ||
Outlier (%) | 0 | 0 | ||
