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. 2020 Mar 18;48(8):4538–4550. doi: 10.1093/nar/gkaa168

Table 2.

NMR and refinement statistics for the RNA-bound and unbound RBM20(513–621)

AUCUUA bound mRBM20 Unbound mRBM20
Number of structures 25 25
Distance constraints
Total 3693 2838
Protein intraresidue 929 823
Protein interresidue
Sequential (|i – j| = 1) 442 385
Short range (1 < |ij| < 4) 199 177
Medium range (3 < |ij| < 6) 79 76
Long range (|ij| > 5) 398 336
RNA 104
Intermolecular 69
Ambiguousa 1445 1041
Hydrogen bonds 28
Total dihedral angle constraints
Protein 254 224
RNA 28
Residual dipolar couplings
1DHN 82
Structure statistics
Violations (mean and SD)
Distance constraints (Å)b 0.018 ± 0.000 0.020 ± 0.001
Dihedral angle constraints (°)c 1.48 ± 0.06 1.40 ± 0.07
Residual dipolar couplings, Qd 0.24 ± 0.01
Deviations from idealized geometry
Bond lengths (Å) 0.004 ± 0.000 0.004 ± 0.000
Bond angles (°) 0.54 ± 0.01 0.51 ± 0.02
Impropers (°) 1.41 ± 0.04 1.5 ± 0.1
Ramachandran plot (%) e
Most favoured 93.5 (88.4) 95.6 (82.1)
Additionally favoured 6.3 (10.1) 4.4 (14.5)
Generally allowed 0.2 (0.6) 0.0 (1.8)
Disallowed 0.0 (0.8) 0.0 (1.5)
Average pairwise rmsd (Å)
Protein backbone 2° structure 0.25 ± 0.04 0.20 ± 0.04
Protein heavy 2° structure 0.56 ± 0.06 0.56 ± 0.07
Protein backbone all 1.5 ± 0.2 3.2 ± 0.8
Protein heavy all 1.9 ± 0.2 3.6 ± 0.8

aA standard class of distance restraints in Aria2.3, derived from cases in which the peak volume is contributed by two or more overlapping NOE crosspeaks

bNo violations >0.5 Å.

cNo violations >10°.

dCalculated for each structure in the ensemble using the method described by (73).

eDetermined by using PROCHECK-NMR (74). Main values display hetNOE > 0.5 and include residues 520–617 for the bound form, and 520–598 for the unbound form. Values that include all residues are in parentheses.