Table 1 X-ray data collection, phasing and refinement statistics of Gp45.
From: Structure of the host-recognition device of Staphylococcus aureus phage ϕ11
Derivative Ta6Br12 | Native | |
|---|---|---|
Data collection | ||
Space group | P1 | P1 |
Cell dimensions | ||
a, b, c (Å) | 87.65, 89.60, 93.73 | 87.06, 89.08, 93.3 |
α, β, γ (°) | 92.7, 105.7, 117.9 | 93.0, 105.2, 117.6 |
Resolution (Å) | 50–3.30 (3.37–3.30) | 44.4–2.20 (2.38–2.20) |
Rmeas | 12.5 (100.4) | 6.6 (57.5) |
CC (1/2) (%) | 99.9 (87.1) | 99.8 (83.5) |
I/σI | 20.4 (2.9) | 12.6 (2.4) |
Completeness (%) | 99.3 (95.0) | 97.1 (97.1) |
Redundancy | 13.7 (12.0) | 3.2 (3.2) |
Phasing | ||
Sites | 12 | |
Anomlaous phasing power | 1.4 (0.143) | |
Figure of merit - acentric | 0.26 (0.05) | |
Refinement | ||
Resolution (Å) | 44.4–2.20 (2.26–2.20) | |
No. reflections | 116,564 (8497) | |
Rwork/Rfree (%) | 17.5/21.1 (21.7/25.1) | |
No. atoms | ||
Protein | 15324 | |
Ligand/ion | 1 | |
Water | 1446 | |
B-factors | ||
Protein | 51.1 | |
Ligand/ion | 33.6 | |
Water | 54.2 | |
R.m.s deviations | ||
Bond lengths (Å) | 0.010 | |
Bond angles (°) | 1.12 | |
