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. 2014 Jul 24;136(33):11767–11775. doi: 10.1021/ja5053126

Table 1. ESEEM Simulation Parameters.

  spmoB_H48N,H72A pMMO
  Cu(II)His2 Cu(II)His2 Cu(II)His
A (MHz) [1.57, 1.07, 2.03] [1.68, 1.18, 2.13] [1.68, 1.18, 2.13]
e2Qq (MHz) 1.51 1.53 1.53
η 0.91 0.87 0.87
A[α, β, γ]° [240, 70, 0] [240, 65, 0]
Q[α, β, γ]° [0, 55, 0] [0, 60, 0]