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. 2020 Mar 10;11:1291. doi: 10.1038/s41467-020-15073-7

Table 1.

Structural statistics for the RAZUL:AZUL complex.

RAZUL AZUL
NMR distance and dihedral constraints
NOE-derived distance constraints
  Intramolecular 705 1084
    Intra-residue 386 412
    Inter-residue 319 672
      Sequential (|i − j| = 1) 192 257
      Nonsequential (|i − j|>1) 127 415
  Intermolecular 217
Hydrogen bonds 15 22
Total dihedral angle constrains 66 110
    ϕ 33 55
    ψ 33 55
Structure statistics
Violations (mean and s.d.)
  Distance constraints (Å) 0
  Dihedral angle constraints (º) 0
  Max. dihedral angle violation (º) <5
  Max. distance constraint violation (Å) <0.3
Deviations from idealized geometry
  Bond lengths (Å) 0.002 ± 0.000
  Bond angles (º) 0.416 ± 0.008
  Impropers (º) 0.283 ± 0.014
Average pairwise r.m.s.d.* (Å)
 Backbone atoms 0.59 ± 0.11
 Heavy atoms 1.24 ± 0.17

*Pairwise r.m.s.d. for the 15 lowest energy structures for V328-A360 from RAZUL and K25-L82 from AZUL.