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* fad *

B-factor analysis for ID 2403301559411589666

Overall B-factor prediction

Correlation= 0.275 for 131 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 MET 1 2.2328 139.5372 62.9400
10 CA GLY 2 0.9341 82.5029 56.8600
14 CA PRO 3 0.1362 47.4670 54.0000
21 CA LYS 4 0.0587 44.0644 49.5600
30 CA ARG 5 0.0272 42.6776 42.7800
41 CA ARG 6 0.0256 42.6095 48.3200
52 CA GLN 7 0.0205 42.3852 50.5200
61 CA LEU 8 0.0205 42.3833 42.9600
69 CA THR 9 0.0263 42.6389 35.3700
76 CA PHE 10 0.0245 42.5632 37.6400
87 CA ARG 11 0.0338 42.9692 40.9000
98 CA GLU 12 0.0289 42.7539 39.4700
107 CA LYS 13 0.0202 42.3717 38.3300
116 CA SER 14 0.0299 42.7984 39.2900
122 CA ARG 15 0.0396 43.2258 42.9900
133 CA ILE 16 0.0254 42.5989 39.8100
141 CA ILE 17 0.0278 42.7066 42.2800
149 CA GLN 18 0.0521 43.7747 49.3000
158 CA GLU 19 0.0473 43.5640 49.6700
167 CA VAL 20 0.0409 43.2801 51.1700
174 CA GLU 21 0.0744 44.7528 58.5600
183 CA GLU 22 0.0997 45.8641 60.6400
192 CA ASN 23 0.0820 45.0862 60.4500
200 CA PRO 24 0.1117 46.3895 63.4600
207 CA ASP 25 0.1751 49.1751 68.0600
215 CA LEU 26 0.0754 44.7957 64.2100
223 CA ARG 27 0.0614 44.1805 61.8500
234 CA LYS 28 0.0329 42.9322 52.9500
243 CA GLY 29 0.0438 43.4072 50.7600
247 CA GLU 30 0.0575 44.0102 50.2200
256 CA ILE 31 0.0363 43.0800 48.4900
264 CA ALA 32 0.0291 42.7617 47.6800
269 CA ARG 33 0.0606 44.1466 50.4600
280 CA ARG 34 0.0648 44.3319 49.0400
291 CA PHE 35 0.0453 43.4763 44.8500
302 CA ASN 36 0.0588 44.0690 46.7600
310 CA ILE 37 0.0277 42.6996 44.3900
318 CA PRO 38 0.0215 42.4297 42.9100
325 CA PRO 39 0.0161 42.1910 43.4500
332 CA SER 40 0.0121 42.0172 42.6400
338 CA THR 41 0.0105 41.9469 38.6800
345 CA LEU 42 0.0123 42.0238 38.5300
353 CA SER 43 0.0138 42.0903 39.2700
359 CA THR 44 0.0135 42.0779 39.9100
366 CA ILE 45 0.0148 42.1352 35.6900
374 CA LEU 46 0.0206 42.3907 40.0800
382 CA LYS 47 0.0319 42.8849 42.0500
391 CA ASN 48 0.0294 42.7746 40.6900
399 CA LYS 49 0.0327 42.9217 42.7100
408 CA ARG 50 0.0598 44.1106 43.6000
419 CA ALA 51 0.0443 43.4317 37.0800
424 CA ILE 52 0.0277 42.7025 35.5900
432 CA LEU 53 0.0391 43.2016 35.9600
440 CA ALA 54 0.0497 43.6664 35.8500
445 CA SER 55 0.0333 42.9467 36.0200
451 CA GLU 56 0.0356 43.0489 38.5500
460 CA ARG 57 0.0563 43.9572 40.0900
471 CA LYS 58 0.0415 43.3087 37.2300
480 CA TYR 59 0.0363 43.0793 36.3100
492 CA GLY 60 0.0543 43.8714 39.0800
496 CA VAL 61 0.0895 45.4167 42.6000
503 CA ALA 62 0.0458 43.4955 39.2000
508 CA SER 63 0.0370 43.1079 39.2700
514 CA THR 64 0.0510 43.7234 40.3200
521 CA CYS 65 0.0510 43.7262 39.7100
527 CA ARG 66 0.0277 42.7021 35.1300
538 CA LYS 67 0.0228 42.4886 37.1400
547 CA THR 68 0.0222 42.4584 34.7500
554 CA ASN 69 0.0249 42.5772 36.3100
562 CA LYS 70 0.0245 42.5599 35.0400
571 CA LEU 71 0.0246 42.5655 35.1400
579 CA SER 72 0.0216 42.4355 35.0600
585 CA PRO 73 0.0291 42.7619 32.8000
592 CA TYR 74 0.0273 42.6855 30.7800
604 CA ASP 75 0.0335 42.9579 30.2400
612 CA LYS 76 0.0581 44.0373 31.3000
621 CA LEU 77 0.0362 43.0734 34.2500
629 CA GLU 78 0.0270 42.6718 38.1700
638 CA GLY 79 0.0533 43.8278 37.3500
642 CA LEU 80 0.0553 43.9116 38.0900
650 CA LEU 81 0.0339 42.9730 41.5800
658 CA ILE 82 0.0420 43.3316 41.8300
666 CA ALA 83 0.0776 44.8933 40.6700
671 CA TRP 84 0.0607 44.1522 45.1000
685 CA PHE 85 0.0500 43.6824 50.9800
696 CA GLN 86 0.0783 44.9229 59.6400
705 CA GLN 87 0.1187 46.6978 59.9700
714 CA ILE 88 0.1028 45.9975 53.6000
722 CA ARG 89 0.1192 46.7187 50.1800
733 CA ALA 90 0.2202 51.1529 48.8500
738 CA ALA 91 0.2907 54.2518 47.9400
743 CA GLY 92 0.3014 54.7217 47.4100
747 CA LEU 93 0.2080 50.6185 48.3400
755 CA PRO 94 0.1760 49.2149 52.2900
762 CA VAL 95 0.0762 44.8319 55.4100
769 CA LYS 96 0.0810 45.0406 56.4900
778 CA GLY 97 0.0435 43.3957 51.9100
782 CA ILE 98 0.0547 43.8882 50.0100
790 CA ILE 99 0.0540 43.8565 46.9100
798 CA LEU 100 0.0278 42.7071 43.9800
806 CA LYS 101 0.0269 42.6670 41.6000
815 CA GLU 102 0.0517 43.7536 45.9000
824 CA LYS 103 0.0415 43.3094 41.6000
833 CA ALA 104 0.0276 42.6977 40.5900
838 CA LEU 105 0.0413 43.3001 41.4000
846 CA ARG 106 0.0688 44.5059 44.8900
857 CA ILE 107 0.0569 43.9821 38.1400
865 CA ALA 108 0.0551 43.9071 41.6300
870 CA GLU 109 0.1017 45.9532 45.9700
879 CA GLU 110 0.1310 47.2369 47.1000
888 CA LEU 111 0.1083 46.2427 42.2500
896 CA GLY 112 0.1499 48.0666 38.4300
900 CA MET 113 0.0791 44.9605 43.5800
908 CA ASP 114 0.1466 47.9221 51.6100
916 CA ASP 115 0.0936 45.5944 52.1400
924 CA PHE 116 0.0352 43.0330 43.3900
935 CA THR 117 0.0298 42.7930 41.2000
942 CA ALA 118 0.0161 42.1914 38.1000
947 CA SER 119 0.0132 42.0644 36.5200
953 CA ASN 120 0.0134 42.0725 39.1100
961 CA GLY 121 0.0104 41.9412 36.8400
965 CA TRP 122 0.0080 41.8378 37.8000
979 CA LEU 123 0.0081 41.8391 38.4200
987 CA ASP 124 0.0135 42.0790 38.7900
995 CA ARG 125 0.0131 42.0606 38.9300
1006 CA PHE 126 0.0124 42.0288 41.5200
1017 CA ARG 127 0.0194 42.3367 50.4600
1028 CA ARG 128 0.0266 42.6547 59.6100
1039 CA ARG 129 0.0218 42.4412 66.4300
1050 CA ARG 130 0.0274 42.6871 77.9500
1061 CA SER 131 0.0347 43.0074 84.0400

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: April 25th, 2023.

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