Type of restraint |
intraresidue |
370 |
63 |
29 |
sequential |
272 |
56 |
46 |
medium (2–5 residues) |
196 |
51 |
19 |
long (>5 residues) |
98 |
0 |
0 |
intermolecular (RIIA–RIIB) |
76 |
|
|
intermolecular (RIIA–AKAP) |
22 or 15 |
22 |
15 |
intermolecular (RIIB–AKAP) |
9 or 8 |
9 |
8 |
dihedral |
50 |
0 |
0 |
hydrogen bond |
63 |
10 |
8 |
Total NOEs |
1046 or 1033 |
201 |
117 |
No. NOEs per residue
|
11.4 or 11.23
|
8.38
|
5.32
|
R.m.s.ds
|
Relative to mean (backbone N, Cα, C′)
|
Relative to mean (heavy atoms)
|
|
Residues |
Ht31(495–511) |
0.453 |
|
|
AKAP79(392–408) |
|
1.10 |
|
RIIα 9–42,9′–42′ |
0.635 |
0.68 |
|
RIIα 9–42,9′–42′, Ht31(495–511) |
0.693 |
|
|
RIIα 9–42,9′–42′, AKAP79(392–408)
|
|
1.01
|
|
Energy (kcal/mol)
|
RIIα–Ht31 complexbest, mean
|
RIIα–AKAP79 complexbest, mean
|
|
Total |
235.22, 243.28 |
219.40, 236.36 |
|
Bond |
14.13, 14.12 |
12.48, 13.22 |
|
Angle |
131.56, 134.27 |
129.55, 133.06 |
|
Improper |
17.68, 17.49 |
17.74, 17.62 |
|
van der Waals |
45.66, 46.62 |
39.03, 42.05 |
|
NOE |
26.20, 30.78 |
20.61, 30.41 |
|