Table 3. Data collection and refinement statistics for Glucose-6-phosphate isomerase (pGI).
pGI | |
Data collection | |
Space group | P1 |
Cell dimensions | |
a, b, c (Å) | 69.8, 72.9, 181.9 |
α, β, ã (°) | 92.5, 97.8, 114.6 |
Resolution (Å) | 179.–2.05 (2.1–2.05) |
R sym | 0.097(0.34) |
I/σI | 7.3 (1.2) |
Completeness (%) | 95.0 (95.0) |
Redundancy | 2.0(2.1) |
Refinement | |
Resolution (Å) | 89–2.05 |
No. reflections | 186581 |
R work/R free | 17.2/23.0 |
No. atoms | |
Protein | 25984 |
Ligand/ion | 1 |
Water | 3262 |
B-factors | |
Protein | 23.1 |
Ligand/ion | 27.5 |
Water | 30.3 |
R.m.s. deviations | |
Bond lengths (Å) | 0.011 |
Bond angles (°) | 1.300 |
*Values in parentheses are for highest-resolution shell.