Experimentally derived restraints | ||
---|---|---|
distance restraints | ||
NOE | 1686 | |
intraresidual | 527 | |
sequential | 343 | |
medium range | 245 | |
long range | 505 | |
ambiguous | 66 | |
hydrogen bonds | 62 | |
dihedral restraints | 225 | |
Restraint violation | ||
average distance restraint violation (Å) | 0.0035 +/− 0.0008 | |
maximum distance restraint violation (Å) | < 0.1 | |
average dihedral restraint violation (°) | 0.10 +/− 0.04 | |
maximum dihedral restraint violation (°) | 2.4 | |
deviation from ideal geometry | ||
bond length (Å) | 0.00064 +/− 0.00005 | |
bond angle (Å) | 0.12 +/− 0.006 | |
Coordinate precision a,b | ||
backbone heavy atoms (Rmsd) (Å) (all / defined secondary structure ) | 1.05 / 0.46 | |
all heavy atoms (Rmsd) (Å) | 1.58 / 0.92 | |
Ramachandran plot statisticsc (%) | 89.7/9.6/0.3/0.4 |