Should you encounter any unexpected behaviour,
please let us know.

* *

B-factor analysis for ID 20112615465264077

Overall B-factor prediction

Correlation= 0.569 for 97 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-SCALED	B-OBS
2 CA ALA 23 0.5536 180.4350 181.6200
7 CA LEU 24 0.3061 129.5001 163.3900
15 CA HIS 25 0.1114 89.4220 128.2600
25 CA TRP 26 0.1172 90.6134 87.0900
39 CA ARG 27 0.2184 111.4446 122.1300
44 CA ALA 28 0.1693 101.3297 131.0300
49 CA ALA 29 0.1135 89.8463 87.0900
54 CA GLY 30 0.1821 103.9602 114.3600
58 CA ALA 31 0.2177 111.3080 137.9700
63 CA ALA 32 0.1274 92.7167 132.9000
68 CA THR 33 0.1088 88.8715 124.1400
75 CA VAL 34 0.1483 97.0029 99.2100
82 CA LEU 35 0.1081 88.7269 101.3200
90 CA LEU 36 0.0816 83.2918 118.0500
98 CA VAL 37 0.0877 84.5270 56.4900
105 CA ILE 38 0.0802 82.9972 69.1100
113 CA VAL 39 0.0541 77.6134 75.8600
120 CA LEU 40 0.0414 75.0011 56.4400
128 CA LEU 41 0.0472 76.1938 46.5800
136 CA ALA 42 0.0516 77.1032 102.0700
141 CA GLY 43 0.0238 71.3857 121.7300
145 CA SER 44 0.0181 70.2183 75.7500
151 CA TYR 45 0.0325 73.1711 96.4800
163 CA LEU 46 0.0348 73.6522 79.9800
171 CA ALA 47 0.0177 70.1344 131.7500
176 CA VAL 48 0.0298 72.6094 103.3000
183 CA LEU 49 0.0639 79.6426 65.7300
191 CA ALA 50 0.0560 78.0109 70.8100
196 CA GLU 51 0.0514 77.0716 140.7400
205 CA ARG 52 0.0840 83.7684 136.1100
216 CA GLY 53 0.2085 109.4068 183.5100
220 CA ALA 54 0.1840 104.3523 129.6000
225 CA PRO 55 0.2500 117.9370 51.6100
232 CA GLY 56 0.0828 83.5283 60.7500
236 CA ALA 57 0.0660 80.0758 108.8700
241 CA GLN 58 0.0690 80.6912 111.1300
250 CA LEU 59 0.0277 72.1821 89.3000
258 CA ILE 60 0.0579 78.4010 82.8100
265 CA THR 61 0.0640 79.6531 80.0000
272 CA TYR 62 0.0470 76.1527 139.5100
284 CA PRO 63 0.0831 83.5893 78.7300
291 CA ARG 64 0.0495 76.6713 60.3100
296 CA ALA 65 0.0213 70.8708 93.6800
301 CA LEU 66 0.0364 73.9700 69.9400
309 CA TRP 67 0.0591 78.6517 68.1200
323 CA TRP 68 0.0268 71.9974 65.1000
337 CA SER 69 0.0274 72.1279 60.1600
343 CA VAL 70 0.0604 78.9094 40.9600
350 CA GLU 71 0.0635 79.5521 89.5700
355 CA THR 72 0.0445 75.6365 61.8600
362 CA ALA 73 0.0587 78.5632 66.9900
367 CA THR 74 0.1013 87.3274 48.1800
374 CA THR 75 0.1047 88.0343 71.5500
381 CA VAL 76 0.1502 97.4086 146.8500
388 CA GLY 77 0.1338 94.0188 148.3400
392 CA TYR 78 0.1184 90.8618 62.8300
404 CA GLY 79 0.1946 106.5531 72.4200
408 CA ASP 80 0.0955 86.1418 83.3200
416 CA LEU 81 0.0426 75.2529 85.9400
424 CA TYR 82 0.0347 73.6326 35.6300
436 CA PRO 83 0.0237 71.3599 57.6100
443 CA VAL 84 0.0569 78.1958 83.5900
450 CA THR 85 0.0629 79.4371 97.1500
457 CA LEU 86 0.1023 87.5392 116.1300
465 CA TRP 87 0.0724 81.3779 70.7000
479 CA GLY 88 0.0296 72.5719 60.4400
483 CA ARG 89 0.0416 75.0484 65.6400
494 CA CYS 90 0.0695 80.7866 74.8600
500 CA VAL 91 0.0328 73.2273 56.7400
507 CA ALA 92 0.0311 72.8826 46.9600
512 CA VAL 93 0.0716 81.2189 85.0200
519 CA VAL 94 0.0651 79.8912 50.5600
526 CA VAL 95 0.0396 74.6411 74.9700
533 CA MET 96 0.0604 78.9129 80.3300
541 CA VAL 97 0.0990 86.8565 79.7900
548 CA ALA 98 0.0806 83.0726 43.5400
553 CA GLY 99 0.0847 83.9241 51.0000
557 CA ILE 100 0.1158 90.3185 85.2000
565 CA THR 101 0.1254 92.2968 55.7400
572 CA SER 102 0.1035 87.7917 79.0500
578 CA PHE 103 0.1141 89.9699 81.6200
589 CA GLY 104 0.1631 100.0672 93.9300
593 CA LEU 105 0.1020 87.4837 61.6400
601 CA VAL 106 0.0943 85.9016 46.8500
608 CA THR 107 0.1499 97.3344 75.4700
615 CA ALA 108 0.1144 90.0314 84.8400
620 CA ALA 109 0.0534 77.4723 66.9000
625 CA LEU 110 0.0987 86.7972 62.9300
633 CA ALA 111 0.1574 98.8893 102.6900
638 CA THR 112 0.0998 87.0334 140.0300
645 CA TRP 113 0.0969 86.4308 96.7800
659 CA PHE 114 0.2078 109.2694 111.3100
670 CA VAL 115 0.2826 124.6481 156.6300
677 CA GLY 116 0.2983 127.8958 125.6900
681 CA ARG 117 0.4881 166.9621 105.6200
689 CA GLU 118 0.8489 241.2323 217.4800
698 CA GLN 119 1.4159 357.9491 179.9500

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

K. Suhre & Y.H. Sanejouand, ElNemo: a normal mode web-server for protein movement analysis and the generation of templates for molecular replacement. Nucleic Acids Research, 32, W610-W614, 2004.
K. Suhre & Y.H. Sanejouand, On the potential of normal mode analysis for solving difficult molecular replacement problems. Acta Cryst. D vol.60, p796-799, 2004 © International Union of Crystallography.

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: October 18th, 2018.

Should you encounter any unexpected behaviour, please let us know.

*** ***

B-factor analysis for ID 20112615465264077

Overall B-factor prediction

B-factors for all residues

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

Should you encounter any unexpected behaviour,
please let us know.

* *