Table 2.
Accessible volume within first and second solvation shell vs. bulk
System | Protein [vol%] | 1st shell (r≤4 Å) [%] | 2nd shell (4 Å < r ≤ 7 Å) [%] | Bulk (r >7 Å) [%] |
---|---|---|---|---|
PG1 | 10 | 22.4 | 14.4 | 63.3 |
PG2 | 14 | 31.7 | 20.4 | 47.9 |
PG3 | 20 | 44.0 | 24.6 | 31.5 |
PG4 | 30 | 65.6 | 26.7 | 7.7 |
PGVH1 | 12 | 28.1 | 16.3 | 55.6 |
PGVH2 | 17 | 37.7 | 19.1 | 43.3 |
PGVH3 | 25 | 53.4 | 22.2 | 24.5 |
PGVH4 | 37 | 76.2 | 19.6 | 4.2 |
PGVH5 | 43 | 86.4 | 13.0 | 0.6 |