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***  HYDROLASE 01-FEB-75 1LYZ  ***

B-factor analysis for ID 2404221630241904959

Overall B-factor prediction

%Bfactors-Wn> Experimental B-factors are nearly constant !

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
     2 CA   LYS      1      0.0272      6.0000      6.0000
    11 CA   VAL      2      0.0225      6.0000      6.0000
    18 CA   PHE      3      0.0143      6.0000      6.0000
    29 CA   GLY      4      0.0222      6.0000      6.0000
    33 CA   ARG      5      0.0171      6.0000      6.0000
    44 CA   CYS      6      0.0200      6.0000      6.0000
    50 CA   GLU      7      0.0225      6.0000      6.0000
    59 CA   LEU      8      0.0106      6.0000      6.0000
    67 CA   ALA      9      0.0109      6.0000      6.0000
    72 CA   ALA     10      0.0190      6.0000      6.0000
    77 CA   ALA     11      0.0191      6.0000      6.0000
    82 CA   MET     12      0.0108      6.0000      6.0000
    90 CA   LYS     13      0.0169      6.0000      6.0000
    99 CA   ARG     14      0.0449      6.0000      6.0000
   110 CA   HIS     15      0.0202      6.0000      6.0000
   120 CA   GLY     16      0.0243      6.0000      6.0000
   124 CA   LEU     17      0.0106      6.0000      6.0000
   132 CA   ASP     18      0.0150      6.0000      6.0000
   140 CA   ASN     19      0.0250      6.0000      6.0000
   148 CA   TYR     20      0.0164      6.0000      6.0000
   160 CA   ARG     21      0.0251      6.0000      6.0000
   171 CA   GLY     22      0.0457      6.0000      6.0000
   175 CA   TYR     23      0.0129      6.0000      6.0000
   187 CA   SER     24      0.0143      6.0000      6.0000
   193 CA   LEU     25      0.0093      6.0000      6.0000
   201 CA   GLY     26      0.0094      6.0000      6.0000
   205 CA   ASN     27      0.0080      6.0000      6.0000
   213 CA   TRP     28      0.0066      6.0000      6.0000
   227 CA   VAL     29      0.0065      6.0000      6.0000
   234 CA   CYS     30      0.0080      6.0000      6.0000
   240 CA   ALA     31      0.0070      6.0000      6.0000
   245 CA   ALA     32      0.0084      6.0000      6.0000
   250 CA   LYS     33      0.0115      6.0000      6.0000
   259 CA   PHE     34      0.0179      6.0000      6.0000
   270 CA   GLU     35      0.0113      6.0000      6.0000
   279 CA   SER     36      0.0124      6.0000      6.0000
   285 CA   ASN     37      0.0184      6.0000      6.0000
   293 CA   PHE     38      0.0124      6.0000      6.0000
   304 CA   ASN     39      0.0148      6.0000      6.0000
   312 CA   THR     40      0.0129      6.0000      6.0000
   319 CA   GLN     41      0.0201      6.0000      6.0000
   328 CA   ALA     42      0.0171      6.0000      6.0000
   333 CA   THR     43      0.0233      6.0000      6.0000
   340 CA   ASN     44      0.0299      6.0000      6.0000
   348 CA   ARG     45      0.0496      6.0000      6.0000
   359 CA   ASN     46      0.0736      6.0000      6.0000
   367 CA   THR     47      0.1987      6.0000      6.0000
   374 CA   ASP     48      0.0983      6.0000      6.0000
   382 CA   GLY     49      0.0520      6.0000      6.0000
   386 CA   SER     50      0.0258      6.0000      6.0000
   392 CA   THR     51      0.0170      6.0000      6.0000
   399 CA   ASP     52      0.0131      6.0000      6.0000
   407 CA   TYR     53      0.0100      6.0000      6.0000
   419 CA   GLY     54      0.0106      6.0000      6.0000
   423 CA   ILE     55      0.0084      6.0000      6.0000
   431 CA   LEU     56      0.0077      6.0000      6.0000
   439 CA   GLN     57      0.0111      6.0000      6.0000
   448 CA   ILE     58      0.0082      6.0000      6.0000
   456 CA   ASN     59      0.0118      6.0000      6.0000
   464 CA   SER     60      0.0099      6.0000      6.0000
   470 CA   ARG     61      0.0192      6.0000      6.0000
   481 CA   TRP     62      0.0196      6.0000      6.0000
   495 CA   TRP     63      0.0110      6.0000      6.0000
   509 CA   CYS     64      0.0100      6.0000      6.0000
   515 CA   ASN     65      0.0163      6.0000      6.0000
   523 CA   ASP     66      0.0234      6.0000      6.0000
   531 CA   GLY     67      0.2232      6.0000      6.0000
   535 CA   ARG     68      0.0587      6.0000      6.0000
   546 CA   THR     69      0.0307      6.0000      6.0000
   553 CA   PRO     70      0.0837      6.0000      6.0000
   560 CA   GLY     71      0.0639      6.0000      6.0000
   564 CA   SER     72      0.0331      6.0000      6.0000
   570 CA   ARG     73      0.0451      6.0000      6.0000
   581 CA   ASN     74      0.0259      6.0000      6.0000
   589 CA   LEU     75      0.0259      6.0000      6.0000
   597 CA   CYS     76      0.0205      6.0000      6.0000
   603 CA   ASN     77      0.0480      6.0000      6.0000
   611 CA   ILE     78      0.0251      6.0000      6.0000
   619 CA   PRO     79      0.0248      6.0000      6.0000
   626 CA   CYS     80      0.0117      6.0000      6.0000
   632 CA   SER     81      0.0252      6.0000      6.0000
   638 CA   ALA     82      0.0236      6.0000      6.0000
   643 CA   LEU     83      0.0106      6.0000      6.0000
   651 CA   LEU     84      0.0158      6.0000      6.0000
   659 CA   SER     85      0.0227      6.0000      6.0000
   665 CA   SER     86      0.0306      6.0000      6.0000
   671 CA   ASP     87      0.0359      6.0000      6.0000
   679 CA   ILE     88      0.0141      6.0000      6.0000
   687 CA   THR     89      0.0270      6.0000      6.0000
   694 CA   ALA     90      0.0181      6.0000      6.0000
   699 CA   SER     91      0.0111      6.0000      6.0000
   705 CA   VAL     92      0.0121      6.0000      6.0000
   712 CA   ASN     93      0.0187      6.0000      6.0000
   720 CA   CYS     94      0.0121      6.0000      6.0000
   726 CA   ALA     95      0.0104      6.0000      6.0000
   731 CA   LYS     96      0.0129      6.0000      6.0000
   740 CA   LYS     97      0.0179      6.0000      6.0000
   749 CA   ILE     98      0.0129      6.0000      6.0000
   757 CA   VAL     99      0.0130      6.0000      6.0000
   764 CA   SER    100      0.0274      6.0000      6.0000
   770 CA   ASP    101      0.0395      6.0000      6.0000
   778 CA   GLY    102      0.1891      6.0000      6.0000
   782 CA   ASN    103      0.0491      6.0000      6.0000
   790 CA   GLY    104      0.0202      6.0000      6.0000
   794 CA   MET    105      0.0128      6.0000      6.0000
   802 CA   ASN    106      0.0246      6.0000      6.0000
   810 CA   ALA    107      0.0252      6.0000      6.0000
   815 CA   TRP    108      0.0181      6.0000      6.0000
   829 CA   VAL    109      0.0412      6.0000      6.0000
   836 CA   ALA    110      0.0223      6.0000      6.0000
   841 CA   TRP    111      0.0143      6.0000      6.0000
   855 CA   ARG    112      0.0241      6.0000      6.0000
   866 CA   ASN    113      0.0502      6.0000      6.0000
   874 CA   ARG    114      0.0336      6.0000      6.0000
   885 CA   CYS    115      0.0179      6.0000      6.0000
   891 CA   LYS    116      0.0306      6.0000      6.0000
   900 CA   GLY    117      0.2178      6.0000      6.0000
   904 CA   THR    118      0.0731      6.0000      6.0000
   911 CA   ASP    119      0.0843      6.0000      6.0000
   919 CA   VAL    120      0.0161      6.0000      6.0000
   926 CA   GLN    121      0.0302      6.0000      6.0000
   935 CA   ALA    122      0.0339      6.0000      6.0000
   940 CA   TRP    123      0.0147      6.0000      6.0000
   954 CA   ILE    124      0.0171      6.0000      6.0000
   962 CA   ARG    125      0.0588      6.0000      6.0000
   973 CA   GLY    126      0.2023      6.0000      6.0000
   977 CA   CYS    127      0.0430      6.0000      6.0000
   983 CA   ARG    128      0.1383      6.0000      6.0000
   994 CA   LEU    129      0.0886      6.0000      6.0000

If you find results from this site helpful for your research, please cite one of our papers:

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.