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. Author manuscript; available in PMC: 2007 Aug 14.
Published in final edited form as: J Chem Theory Comput. 2006;2(3):696–704. doi: 10.1021/ct600060d

Table 2. The optimum cutoff radii (Å) for eight proteins in the data set for four different resolution level models.

The correlation coefficients are given in parentheses.

1ucs 1iua 1r6j 1w0n 1mc2 1nwz 1v6p 1f9y
Residue 8 (0.65) 13 (0.54) 14 (0.76) 12 (0.48) 7 (0.60) 10 (0.54) 6 (0.63) 19 (0.78)
Atom 4 (0.67) 5 (0.56) 14 (0.72) 8 (0.58) 5 (0.73) 4 (0.67) 7 (0.64) 22 (0.78)
Proton 3 (0.66) 5 (0.54) 15 (0.71) 8 (0.59) 5 (0.68) 3 (0.63) 7 (0.67) 23 (0.78)
Solvent 15 (0.59) 15 (0.53) 18 (0.69) 9 (0.51) 5 (0.62) 10 (0.66) 7 (0.64) 23 (0.78)