Table_1.xls (9.5 kB)
Statistics for data collection, phasing, and model refinement.
dataset
posted on 2014-10-30, 03:58 authored by Mi Seul Park, Eduard Bitto, Kyung Rok Kim, Craig A. Bingman, Mitchell D. Miller, Hyun-Jung Kim, Byung Woo Han, George N. Phillips Jra
Data collected at the Sector 23-ID-D of the Advanced Photon Source.
bNumbers in parentheses indicate the highest resolution shell of 20.
cRmerge = Σh Σi |I(h)i–<I(h)>|/Σh ΣiI(h)i, where I(h) is the observed intensity of reflection h, and <I(h)> is the average intensity obtained from multiple measurements.
dFigure of merit = <|Σ P(α)eiα/Σ P(α)|>, where α is the phase angle and P(α) is the phase probability distribution.
eRwork = Σ | |Fo|–|Fc| |/Σ |Fo|, where |Fo| is the observed structure factor amplitude and |Fc| is the calculated structure factor amplitude.
fRfree = R-factor based on 5.0% of the data excluded from refinement.
Statistics for data collection, phasing, and model refinement.