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. 2008 Jul 31;64(Pt 8):m1098–m1099. doi: 10.1107/S1600536808023623
Refinement on F2 Secondary atom site location: difference Fourier map
Least-squares matrix: full Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.021 H-atom parameters constrained
wR(F2) = 0.048   w = 1/[σ2(Fo2) + (0.021P)2 + 1.1255P] where P = (Fo2 + 2Fc2)/3
S = 1.04 (Δ/σ)max = 0.001
6605 reflections Δρmax = 0.95 e Å3
452 parameters Δρmin = −0.79 e Å3
77 restraints Extinction correction: none
Primary atom site location: structure-invariant direct methods