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. 2012 Feb 24;287(16):13194–13205. doi: 10.1074/jbc.M112.339655

TABLE 1.

Structural statistics of 20 conformers of Dph4

Total restraints 1761
Distance restraints (upper limit)
    All 1558
    NOE intraresidue 478
    Short range 461
    Medium range 271
    Long range 223
    Hydrogen bonds 116
    Zinc distance restraints 9

Dihedral angle constraints (°)
    ϕ 104
    ψ 99
Mean CYANA target function 2.13 ± 0.92

Ramachandran plot statistics: all residues (selected residuesa) (%)
    Most favored regions 74.7 (86.3)
    Additionally allowed regions 22.1 (13.5)
    Generously allowed regions 2.2 (0.2)
    Disallowed regions 1.0 (0.0)

r.m.s. deviation values (Å)b
    N-terminal domain
        Residues 11–72 1.53 ± 0.40
        Helix 1 (residues 11–16) 0.27 ± 0.15
        Helix 2 (residues 24–38) 0.39 ± 0.17
        Helix 3 (residues 50–68) 0.52 ± 0.20
    Linker (residues 76–93)
        Helix 5 (residues 77–88) 0.15 ± 0.06
    C-terminal domain
        Residues 94–149 1.05 ± 0.28
Ordered residues (95–98, 103–105, 110–114, 120–124, 127–130, 133–135, and 142–146) 0.62 ± 0.14

a Selected residues were as follows: 12–38, 50–69, 71–74, 77–90, 95–117, 120–137, and 142–146. Ramachandran plot statistics were obtained using PROCHECK. The residues observed in disallowed regions (1%) belonged to loop regions.

b r.m.s. deviations were evaluated using MOLMOL.