Table 3.
Crystal structure data collection and refinement statistics.
MS3-6/STAT3-CF | |
---|---|
Data collection | |
Space group | P 41 21 2 |
Cell dimensions | |
a, b, c (Å) | 111.31, 111.31, 483.47 |
α, β, γ (°) | 90.00, 90.00, 90.00 |
Resolution (Å) | 49.78–2.90 (3.1–2.9)a |
Rmeas | 34.4 (447.9) |
CC1/2 | 99.8 (25.2) |
I / σI | 8.5 (0.61) |
Completeness (%) | 99.9 (99.8) |
Redundancy | 14.27 (14.55) |
Refinement | |
Resolution (Å) | 2.9 |
No. reflections | 68566 |
Rwork/Rfree | 0.246/0.280 |
No. atoms | |
Protein | 10063 |
Water | 2 |
B-factors | |
Protein | 83.24 |
Water | 35.64 |
R.m.s. deviations | |
Bond lengths (Å) | 0.015 |
Bond angles (°) | 1.934 |
Molprobity score | 2.61 |
aOne crystal per structure. PDB: 6TLC. Values in parenthesis are for the highest resolution shell.