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. 2014 Jun 17;1(3):034701. doi: 10.1063/1.4883975

TABLE III.

Occupancy values (%) of each platinum atom at the Nδ and Nε binding sites of His-15. Occupancies were calculated using SHELX12 and the errors on the occupancies were calculated using the full matrix inversion in SHELXL.

  Nδ binding site Nε binding site
  Pt 1 Pt 2 Pt 1 Pt 2 Pt 3 Pt 4
Cisplatin HEWL crystal at 150 K 22 +/− 5 13 +/− 12 7 +/− 9 60 +/− 2 22 +/− 9 25 +/− 8
Cisplatin HEWL crystal at 200 K 29 +/− 10   14 +/− 9   16 +/− 12 44 +/− 13
Cisplatin HEWL crystal at RT 36 +/− 2       29 +/− 2 33 +/− 2
Carboplatin HEWL crystal at 200 K 20 +/− 5       32 +/− 7 23 +/− 8