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. 2018 Sep 25;46(19):10514–10529. doi: 10.1093/nar/gky836

Table 1.

Restraints and structural statistics for Rok-C97-191 and Rok-C102-185/Seq1 complex

Rok-C97–191 Rok-C102–185/Seq1
Restrains for protein
 NOE 3078 2542
  Intra-residues 858 687
  Inter-residues 1046 822
   Sequential 452 393
   Non-sequential 594 429
  Ambiguous 1174 1033
 Dihedral angle restraints 110 110
  φ angle 57 55
  ψ angle 57 55
 Chirality restraints 385 351
  ω angle 103 92
  Chirality 282 259
Restraints for DNA
 NOE 983
 Hydrogen bonds 62
 Sugar pucker 36
 Backbone dihedral angle 244
Protein–DNA intermolecular NOE 62
 Distance restraints violations (>0.2 Å) 0 0
 Dihedral angle restraints violations (>5°) 0 0
 Average pairwise RMSD (Å)
 Protein (all heavy atoms) 1.04 ± 0.08 0.99 ± 0.19
Protein (backbone heavy atoms) 0.40 ± 0.10 0.44 ± 0.13
 DNA (all heavy atoms) 0.69 ± 0.21
 Complex (all heavy atoms) 0.71 ± 0.19
Ramachandran plot
 Most favored regions (%) 92.8 88.5
 Additionally allowed regions (%) 7.2 11.5
 Generously allowed regions (%) 0.1 0
 Disallowed regions (%) 0 0