NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
503017 2kwy cing 1-original 3 DYANA/DIANA unknown


    Structural statistics:
 
    str   target     upper limits     lower limits    van der Waals   torsion angles
        function   #    rms   max   #    rms   max   #    sum   max   #    rms   max
      1 2.80E-02   0 0.0057  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0071  0.06
      2 2.81E-02   0 0.0057  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0065  0.06
      3 2.83E-02   0 0.0057  0.08   0 0.0001  0.00   0    0.2  0.05   0 0.0084  0.07
      4 2.84E-02   0 0.0057  0.08   0 0.0002  0.00   0    0.1  0.05   0 0.0082  0.07
      5 2.84E-02   0 0.0057  0.08   0 0.0002  0.00   0    0.1  0.05   0 0.0082  0.07
      6 2.84E-02   0 0.0057  0.08   0 0.0003  0.00   0    0.1  0.05   0 0.0073  0.06
      7 2.85E-02   0 0.0058  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0083  0.07
      8 2.86E-02   0 0.0058  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0075  0.07
      9 2.86E-02   0 0.0058  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0075  0.07
     10 2.87E-02   0 0.0058  0.08   0 0.0002  0.00   0    0.1  0.05   0 0.0087  0.07
 
    Ave 2.84E-02   0 0.0057  0.08   0 0.0002  0.00   0    0.1  0.05   0 0.0078  0.07
    +/- 2.16E-04   0 0.0000  0.00   0 0.0001  0.00   0    0.0  0.00   0 0.0007  0.01
    Min 2.80E-02   0 0.0057  0.08   0 0.0001  0.00   0    0.1  0.05   0 0.0065  0.06
    Max 2.87E-02   0 0.0058  0.08   0 0.0003  0.00   0    0.2  0.05   0 0.0087  0.07
    Cut                      0.20             0.20             0.20             5.00
 
    Constraints violated in 3 or more structures:
                                                   #   mean   max.  1   5   10
    0 violated distance constraints.
    0 violated van der Waals constraints.
    0 violated angle constraints.
 
    RMSDs for residues 1..20:
    Average backbone RMSD to mean   :    1.03 +/- 0.37 A (0.51..1.72 A; 10 structures)
    Average heavy atom RMSD to mean :    1.78 +/- 0.36 A (1.32..2.45 A; 10 structures)
# Simulated annealing and violation analysis

read seq G61-101.seq



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