Distance constraints |
Long (intramolecuar) |
431 |
Long (intermolecular) |
55 |
Medium [1<(i–j)≤5] |
401 |
Sequential [2 (i–j)=1] |
519 |
Intraresidue [i=j] |
852 |
Dihedral angle constraints (ϕ and Ψ) |
163 |
Hydrogen bonds |
46 |
DNH residual dipolar couplings |
94 |
|
Target function ( Å2) |
2.68 ± 0.49 |
|
Average atomic R.M.S.D. to the mean structure (Å) |
|
Dimer (residues 10–122 of the construct) |
Backbone ( Cα, C′, N, O) |
1.09 ± 0.19 |
Heavy atoms |
1.45 ± 0.15 |
Monomer I (residues 10–122 of the construct) |
Backbone ( Cα, C′, N, O) |
0.78 ± 0.12 |
Heavy atoms |
1.21 ± 0.10 |
Monomer II (residues 10–122 of the construct) |
Backbone ( Cα, C′, N, O) |
0.82 ± 0.12 |
Heavy atoms |
1.25 ± 0.10 |
Deviations from idealized covalent geometry |
Bond (Å) |
0.018 ± 0.001 |
Angles (°) |
1.901 ± 0.089 |
Impropers (°) |
1.744 ± 0.091 |
|
R.M.S.D. from experimental distance constraints (Å) |
0.019 ± 0.003 |
|
R.M.S.D. from experimental dihedral constraints (Å) |
0.468 ± 0.064 |
|
Ramachandran statistics (% of all residues) |
|
Most favored |
84.23 ± 1.63 |
Additionally allowed |
12.72 ± 1.61 |
Generously allowed |
2.47 ± 0.90 |
Disallowed |
0.58 ± 0.47 |