Table 3. Occupancies and B factors of O atoms in the magnesium-containing water cluster of reduced CcO.
| Name | No./Chain ID | B factor (Å2) | Occupancy |
|---|---|---|---|
| 1 | 707/A | 27.47 | 1 |
| 2 | 824/A | 26.03 | 1 |
| 3 | 840/A | 30.48 | 1 |
| 4 | 834/A | 26.89 | 1 |
| 5 | 813/A | 27.82 | 1 |
| 6 | 863/A | 29.37 | 1 |
| 7 | 407/B | 29.22 | 1 |
| 8 | 538/B | 24.51 | 1 |
| 9 | 418/B | 27.75 | 1 |
| 10 | 735/A | 28.42 | 1 |
| 11 | 888/A | 27.21 | 1 |
| 12 | 821/A | 26.99 | 1 |
| 13 | 811/A | 27.60 | 1 |
| 14 | 734/A | 29.25 | 1 |
| 15 | 737/A | 29.98 | 1 |
| 16 | 758/A | 28.84 | 1 |
| 17 | 451/B | 27.46 | 0.95 |
| 18 | 436_A/B | 25.83 | 0.60 |
| 19 | 436_B/B | 26.37 | 0.40 |
| 20 | 805/A | 25.98 | 0.60 |
| 21 | 415/B | 28.36 | 0.95 |
| 22 | 431/B | 27.36 | 0.90 |
| Total | 20.40 |