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B-factor analysis for ID 240129114322756599

Overall B-factor prediction

Correlation= 0.335 for 12 C-alpha atoms.

B-factors for all residues

Residue-by-residue B-factor prediction for CA atoms

B-factors are computed based on the first 100 normal modes (B-PREDICT) and are scaled to match the overall B-factors in the submitted model (B-SCALED). A high correlation with the observations is an indicator that the normal modes capture well the overall flexibility features of the model. Comparison of the observed (B-OBS, blue) and the computed (B-SCALED, red) B-factors for all C-alpha atoms is presented below. Differences between B-factors from normal mode analysis and from X-ray crystallographic data may for example indicate regions where the protein flexibility is modified due to external factors such as tight crystall-packing. 

  ATOM TYP  RES  RESID   B-PREDICT    B-SCALED      B-OBS
B-SCALEDB-OBS
     3 CA   PHE      1      0.0202      0.6374      1.0400
    23 CA   ILE      2      0.0146      0.3952      0.6200
    44 CA   PRO      3      0.0186      0.5675      0.5300
    56 CA   LEU      4      0.0136      0.3501      0.4400
    75 CA   VAL      5      0.0123      0.2935      0.4400
    91 CA   ALA      6      0.0126      0.3058      0.3800
   111 CA   GLY      7      0.0223      0.7289      0.3100
   118 CA   LEU      8      0.0123      0.2950      0.3300
   137 CA   PHE      9      0.0114      0.2560      0.3300
   157 CA   ALA     10      0.0249      0.8417      0.4100
   165 CA   LEU     11      0.0189      0.5805      0.4600
   184 CA   LEU     12      0.0228      0.7484      0.7100

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elNémo is maintained by Yves-Henri Sanejouand.
It was developed by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Last modification: April 25th, 2023.