Table 1. Definition of iron sites.
Data collection | ||||
Dataset | FEHR | FE0 | FE30 | FE120 |
Refinement statistics (cns/refmac) | ||||
Iron content* | Low (0 min) | Low (0 min) | High (30 min) | High (120 min) |
No. of irons in TS† | 0 | 0 | 3 (T1-T3) | 3 (T1-T3) |
No. of irons in FOC† | 1 (F1) | 1 (F1) | 3 (F1-F3) | 1 (F1) |
No. of irons in NI† | 0 | 0 | 3 (N11-N13) | 3 (N11-N13) |
No. of irons in NII† | 1 (N21) | 1 (N21) | 5 (N21-N25) | 5 (N21-N25) |
Incubation time of crystals with Fe2+ solutions is given in parentheses.
Definition of the subsites used in the text is given in parentheses.