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

* *

B-factor analysis for ID 22120310140914123

Overall B-factor prediction

Correlation= 0.668 for 115 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 CYS 10 0.0206 12.1898 30.5000
10 CA PRO 11 0.0123 10.6620 17.3400
17 CA LEU 12 0.0089 10.0321 13.7100
25 CA MET 13 0.0133 10.8414 12.4900
37 CA VAL 14 0.0102 10.2678 9.5400
44 CA LYS 15 0.0131 10.8101 10.7200
57 CA VAL 16 0.0094 10.1249 8.8300
64 CA LEU 17 0.0133 10.8522 8.7600
75 CA ASP 18 0.0135 10.8869 8.1500
83 CA ALA 19 0.0264 13.2579 8.2600
88 CA VAL 20 0.0434 16.3830 9.9300
95 CA ARG 21 0.0477 17.1725 14.3500
106 CA GLY 22 0.0937 25.6149 10.4200
110 CA SER 23 0.0438 16.4545 10.0400
117 CA PRO 24 0.0192 11.9296 10.4600
124 CA ALA 25 0.0118 10.5784 9.3600
129 CA ILE 26 0.0171 11.5482 10.1100
137 CA ASN 27 0.0220 12.4506 10.5000
145 CA VAL 28 0.0109 10.4047 9.9900
152 CA ALA 29 0.0154 11.2275 9.3900
157 CA VAL 30 0.0117 10.5541 9.0600
164 CA HIS 31 0.0140 10.9723 9.5900
174 CA VAL 32 0.0111 10.4367 9.5800
181 CA PHE 33 0.0110 10.4135 11.6200
192 CA ARG 34 0.0110 10.4191 12.1100
203 CA LYS 35 0.0201 12.0979 15.3300
217 CA ALA 36 0.0488 17.3655 19.2100
222 CA ALA 37 0.1970 44.5932 30.9200
227 CA ASP 38 0.1797 41.4167 34.5000
235 CA ASP 39 0.0949 25.8410 38.0300
243 CA THR 40 0.0655 20.4331 30.7200
250 CA TRP 41 0.0258 13.1475 20.9700
264 CA GLU 42 0.0311 14.1224 17.1100
273 CA PRO 43 0.0350 14.8371 14.9300
280 CA PHE 44 0.0142 11.0167 13.1900
291 CA ALA 45 0.0242 12.8512 11.5600
296 CA SER 46 0.0220 12.4373 9.2000
304 CA GLY 47 0.0206 12.1945 9.6900
308 CA LYS 48 0.0215 12.3548 12.0500
317 CA THR 49 0.0148 11.1203 9.3900
324 CA SER 50 0.0261 13.1985 12.7500
330 CA GLU 51 0.0605 19.5071 17.2700
339 CA SER 52 0.0292 13.7645 15.4300
345 CA GLY 53 0.0136 10.8916 11.5400
349 CA GLU 54 0.0157 11.2838 10.9900
358 CA LEU 55 0.0140 10.9789 10.8400
366 CA HIS 56 0.0246 12.9168 18.7200
376 CA GLY 57 0.0332 14.5003 18.8400
380 CA LEU 58 0.0160 11.3336 13.7000
388 CA THR 59 0.0182 11.7436 14.4800
395 CA THR 60 0.0272 13.4007 16.8200
402 CA GLU 61 0.0241 12.8301 21.0600
415 CA GLU 62 0.0691 21.0975 17.7300
424 CA GLU 63 0.0298 13.8694 11.6400
438 CA PHE 64 0.0124 10.6756 10.2100
449 CA VAL 65 0.0246 12.9254 10.3900
456 CA GLU 66 0.0221 12.4682 11.5000
470 CA GLY 67 0.0170 11.5315 12.5100
474 CA ILE 68 0.0147 11.0990 9.9100
482 CA TYR 69 0.0090 10.0542 9.7200
494 CA LYS 70 0.0119 10.5939 11.0200
503 CA VAL 71 0.0109 10.3975 11.2300
510 CA GLU 72 0.0130 10.7864 11.1500
524 CA ILE 73 0.0098 10.1946 10.0300
532 CA ASP 74 0.0125 10.6892 10.8400
544 CA THR 75 0.0090 10.0557 10.0600
551 CA LYS 76 0.0159 11.3177 11.4900
562 CA SER 77 0.0206 12.1945 19.3600
570 CA TYR 78 0.0120 10.6146 18.1500
582 CA TRP 79 0.0137 10.9259 18.0500
596 CA LYS 80 0.0303 13.9749 25.6900
605 CA ALA 81 0.0623 19.8478 22.0800
610 CA LEU 82 0.0491 17.4229 24.2300
618 CA GLY 83 0.1936 43.9617 27.6100
622 CA ILE 84 0.0386 15.4925 19.9300
630 CA SER 85 0.0493 17.4502 22.3400
637 CA PRO 86 0.0228 12.5913 15.4700
644 CA PHE 87 0.0369 15.1826 13.6500
655 CA HIS 88 0.0224 12.5182 9.4300
665 CA GLU 89 0.0279 13.5196 10.5000
674 CA HIS 90 0.0164 11.4201 11.5000
684 CA ALA 91 0.0145 11.0736 14.3100
689 CA GLU 92 0.0192 11.9338 20.9000
698 CA VAL 93 0.0170 11.5286 13.4600
705 CA VAL 94 0.0223 12.4918 9.6600
712 CA PHE 95 0.0199 12.0550 9.0200
723 CA THR 96 0.0266 13.2893 9.7200
730 CA ALA 97 0.0147 11.1105 10.7300
735 CA ASN 98 0.0189 11.8765 15.1100
743 CA ASP 99 0.0459 16.8248 22.5000
755 CA SER 100 0.1098 28.5773 22.2500
761 CA GLY 101 0.0628 19.9371 19.7500
765 CA PRO 102 0.0319 14.2657 16.1500
772 CA ARG 103 0.0192 11.9366 13.4500
783 CA ARG 104 0.0155 11.2520 13.0600
794 CA TYR 105 0.0110 10.4151 10.0000
806 CA THR 106 0.0153 11.2057 10.8500
813 CA ILE 107 0.0110 10.4307 10.8400
821 CA ALA 108 0.0179 11.6886 12.1900
826 CA ALA 109 0.0133 10.8442 9.6600
831 CA LEU 110 0.0165 11.4401 8.5400
842 CA LEU 111 0.0106 10.3417 8.5400
850 CA SER 112 0.0178 11.6646 9.0200
857 CA PRO 113 0.0215 12.3590 10.6300
864 CA TYR 114 0.0381 15.4002 10.5100
876 CA SER 115 0.0344 14.7279 9.8200
884 CA TYR 116 0.0188 11.8463 10.1800
896 CA SER 117 0.0312 14.1311 10.7100
904 CA THR 118 0.0216 12.3631 10.5200
914 CA MET 119 0.0500 17.5941 12.7000
926 CA ALA 120 0.0320 14.2779 9.1700
931 CA VAL 121 0.0483 17.2759 10.1500
938 CA VAL 122 0.0324 14.3613 10.2900
945 CA THR 123 0.0445 16.5832 16.3000
955 CA ASN 124 0.0800 23.1010 21.5800

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 22120310140914123

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.

* *