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. Author manuscript; available in PMC: 2021 Oct 25.
Published in final edited form as: Biochemistry. 2020 Jul 10;59(29):2718–2728. doi: 10.1021/acs.biochem.0c00285

Table 1.

NMR Structure Statistics for the BCOR PUFD

no. of NMR distance constraints
 total NOE 1212
 intraresidue 588
 sequential (∣ij∣ = 1) 308
 medium-range (∣ij∣ < 4) 132
 long-range (∣ij∣ > 5) 184
statistics for the ensemble of accepted structures
 violations (mean and standard deviation)
  distance constraints (0.5 Å) 1 ± 1
  J coupling constraints (1 Hz) 0 ± 0
  maximum distance constraint violation (Å) 0.54 ± 0.03
 deviations from idealized geometry
  bond lengths (Å) 0.040 ± 0.0002
  bond angles (deg) 0.59 ± 0.03
  impropers (deg) 1.56 ± 0.09
average pairwise RMSD (Å)
 structurally ordereda
   backbone N, Cα, CO 3.37
   heavy atoms 4.39
 secondary structure
   backbone N, Cα, CO 2.54
   heavy atoms 3.52
a

Structurally ordered residues were defined as residues with T2 relaxation times of <100 ms (residues 1653–1737).