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

* 4XFX *

B-factor analysis for ID 240228060830932497

Overall B-factor prediction

Correlation= 0.576 for 216 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 PRO 1 0.0505 36.3447 76.6700
9 CA ILE 2 0.0726 39.6011 77.1800
17 CA VAL 3 0.1679 53.6860 88.2100
24 CA GLN 4 0.3776 84.6850 95.0100
29 CA MET 5 0.1956 57.7809 79.6700
34 CA VAL 6 0.1712 54.1819 85.4100
41 CA HIS 7 0.0905 42.2492 73.3600
51 CA GLN 8 0.0906 42.2722 75.9700
60 CA ALA 9 0.0846 41.3842 52.8800
65 CA ILE 10 0.0610 37.8928 47.4400
73 CA SER 11 0.1172 46.2037 37.7700
79 CA PRO 12 0.1347 48.7799 41.5900
86 CA ARG 13 0.1293 47.9893 52.7300
97 CA THR 14 0.0805 40.7820 42.4800
104 CA LEU 15 0.0602 37.7744 33.9800
112 CA ASN 16 0.0865 41.6622 33.7500
120 CA ALA 17 0.0797 40.6594 34.2700
125 CA TRP 18 0.0540 36.8635 29.8000
139 CA VAL 19 0.0628 38.1641 28.9500
146 CA LYS 20 0.0901 42.1934 37.9400
155 CA VAL 21 0.0739 39.8014 34.2700
162 CA VAL 22 0.0632 38.2221 31.3200
169 CA GLU 23 0.0973 43.2602 47.1100
178 CA GLU 24 0.1277 47.7490 58.4700
187 CA LYS 25 0.0992 43.5340 48.4600
196 CA ALA 26 0.0816 40.9356 55.6900
201 CA PHE 27 0.0646 38.4235 51.7100
212 CA SER 28 0.0823 41.0478 37.4400
218 CA PRO 29 0.0778 40.3693 32.3600
225 CA GLU 30 0.0877 41.8410 36.1400
234 CA VAL 31 0.0660 38.6338 35.3000
241 CA ILE 32 0.0598 37.7146 28.7600
249 CA PRO 33 0.0787 40.5164 28.0200
256 CA MET 34 0.0685 38.9951 31.5100
264 CA PHE 35 0.0462 35.7136 27.8200
275 CA SER 36 0.0521 36.5730 33.8100
281 CA ALA 37 0.0704 39.2870 40.6900
286 CA LEU 38 0.0536 36.7949 32.9200
294 CA SER 39 0.0408 34.9149 38.6100
300 CA GLU 40 0.0696 39.1651 45.8800
309 CA GLY 41 0.0544 36.9192 40.5400
313 CA ALA 42 0.0322 33.6364 41.2800
318 CA THR 43 0.0231 32.2900 38.1000
325 CA PRO 44 0.0150 31.0915 35.1600
332 CA GLN 45 0.0212 32.0085 37.0000
341 CA ASP 46 0.0235 32.3568 33.2100
349 CA LEU 47 0.0169 31.3695 27.3600
357 CA ASN 48 0.0175 31.4721 25.0500
365 CA THR 49 0.0256 32.6563 26.3200
372 CA MET 50 0.0260 32.7278 25.2800
380 CA LEU 51 0.0251 32.5919 24.4600
388 CA ASN 52 0.0367 34.2969 21.9900
396 CA THR 53 0.0454 35.5948 20.7400
403 CA VAL 54 0.0478 35.9362 21.9000
410 CA GLY 55 0.0810 40.8512 27.5000
414 CA GLY 56 0.1031 44.1125 28.7800
418 CA HIS 57 0.0636 38.2833 29.6600
428 CA GLN 58 0.0612 37.9279 25.8800
437 CA ALA 59 0.0655 38.5638 21.7300
442 CA ALA 60 0.0491 36.1307 21.5500
447 CA MET 61 0.0381 34.5056 22.4500
455 CA GLN 62 0.0495 36.2015 27.9000
464 CA MET 63 0.0429 35.2251 27.3400
472 CA LEU 64 0.0319 33.5905 27.2200
480 CA LYS 65 0.0368 34.3243 30.5600
489 CA GLU 66 0.0480 35.9702 29.2900
498 CA THR 67 0.0390 34.6481 23.8600
505 CA ILE 68 0.0280 33.0160 25.7200
513 CA ASN 69 0.0449 35.5074 28.7900
521 CA GLU 70 0.0601 37.7631 31.6000
530 CA GLU 71 0.0470 35.8219 31.1000
539 CA ALA 72 0.0398 34.7622 34.6600
544 CA ALA 73 0.0793 40.5958 36.5500
549 CA GLU 74 0.0996 43.5912 40.0900
558 CA TRP 75 0.0693 39.1152 39.5700
572 CA ASP 76 0.0776 40.3486 39.8000
580 CA ARG 77 0.1432 50.0376 52.2200
591 CA LEU 78 0.1611 52.6941 58.9000
599 CA HIS 79 0.1251 47.3669 59.3000
609 CA PRO 80 0.1518 51.3163 67.6700
616 CA VAL 81 0.1537 51.5988 79.3800
623 CA HIS 82 0.2658 68.1631 81.6600
633 CA ALA 83 0.5374 108.3030 87.3900
638 CA GLY 84 0.5975 117.1807 90.1500
642 CA PRO 85 0.5537 110.7058 85.0400
649 CA ILE 86 0.2958 72.5966 70.5900
657 CA ALA 87 0.5488 109.9846 61.6700
662 CA PRO 88 0.8274 151.1596 74.9000
669 CA GLY 89 0.6543 125.5798 74.2300
673 CA GLN 90 0.2931 72.1926 65.0300
682 CA MET 91 0.1244 47.2654 59.1800
690 CA ARG 92 0.1086 44.9321 55.9600
701 CA GLU 93 0.0926 42.5619 69.4100
710 CA PRO 94 0.0537 36.8135 51.0400
717 CA ARG 95 0.0485 36.0412 46.4800
728 CA GLY 96 0.0361 34.2180 40.5100
732 CA SER 97 0.0336 33.8427 36.0200
738 CA ASP 98 0.0301 33.3302 35.9100
746 CA ILE 99 0.0206 31.9180 36.0400
754 CA ALA 100 0.0163 31.2858 29.3000
759 CA GLY 101 0.0204 31.8896 34.4500
763 CA THR 102 0.0412 34.9687 36.4500
770 CA THR 103 0.0563 37.2028 45.0200
777 CA SER 104 0.0464 35.7418 41.5600
783 CA THR 105 0.0631 38.2034 44.3100
790 CA LEU 106 0.0504 36.3282 54.0200
798 CA GLN 107 0.0791 40.5618 67.6300
807 CA GLU 108 0.0609 37.8735 54.3700
816 CA GLN 109 0.0361 34.2071 57.2300
825 CA ILE 110 0.0539 36.8480 72.2700
833 CA GLY 111 0.0728 39.6327 74.0500
837 CA TRP 112 0.0610 37.9010 58.2600
851 CA MET 113 0.0623 38.0817 63.0900
859 CA THR 114 0.0994 43.5636 72.0600
866 CA HIS 115 0.1359 48.9562 87.4600
876 CA ASN 116 0.2065 59.3904 90.6600
884 CA PRO 117 0.2275 62.5070 95.3300
891 CA PRO 118 0.1433 50.0564 86.1800
898 CA ILE 119 0.0742 39.8473 66.8800
906 CA PRO 120 0.0591 37.6200 46.3500
913 CA VAL 121 0.0303 33.3611 42.3100
920 CA GLY 122 0.0270 32.8622 43.4600
924 CA GLU 123 0.0425 35.1666 44.3500
933 CA ILE 124 0.0394 34.6988 35.7100
941 CA TYR 125 0.0222 32.1549 28.1400
953 CA LYS 126 0.0289 33.1434 31.6900
962 CA ARG 127 0.0472 35.8616 34.9900
973 CA TRP 128 0.0354 34.1153 29.7300
987 CA ILE 129 0.0273 32.9138 26.3000
995 CA ILE 130 0.0431 35.2459 29.8100
1003 CA LEU 131 0.0510 36.4101 32.7400
1011 CA GLY 132 0.0404 34.8441 27.2200
1015 CA LEU 133 0.0447 35.4824 26.2500
1023 CA ASN 134 0.0599 37.7332 33.3800
1031 CA LYS 135 0.0595 37.6675 38.6800
1040 CA ILE 136 0.0561 37.1725 34.4900
1048 CA VAL 137 0.0643 38.3742 35.1800
1055 CA ARG 138 0.0719 39.5109 51.7000
1066 CA MET 139 0.0827 41.1072 62.5600
1074 CA TYR 140 0.0793 40.6004 58.9300
1086 CA SER 141 0.0851 41.4486 59.6000
1092 CA PRO 142 0.1605 52.6015 67.8100
1099 CA THR 143 0.0930 42.6288 56.5300
1106 CA SER 144 0.0876 41.8211 41.0500
1112 CA ILE 145 0.0541 36.8698 33.6600
1120 CA LEU 146 0.0817 40.9576 42.6400
1128 CA ASP 147 0.0909 42.3070 39.0200
1136 CA ILE 148 0.0502 36.3050 42.0500
1144 CA ARG 149 0.0703 39.2630 45.9200
1155 CA GLN 150 0.0800 40.7044 36.8600
1164 CA GLY 151 0.1790 55.3370 45.5300
1168 CA PRO 152 0.2579 67.0002 49.5000
1175 CA LYS 153 0.3110 74.8403 53.4600
1184 CA GLU 154 0.1884 56.7161 40.2600
1193 CA PRO 155 0.1723 54.3402 42.3300
1200 CA PHE 156 0.0980 43.3549 43.4800
1211 CA ARG 157 0.1299 48.0755 38.8100
1222 CA ASP 158 0.1224 46.9636 35.0000
1230 CA TYR 159 0.0590 37.5970 32.1600
1242 CA VAL 160 0.0495 36.1954 32.2600
1249 CA ASP 161 0.0796 40.6428 27.7400
1257 CA ARG 162 0.0575 37.3739 27.2100
1268 CA PHE 163 0.0281 33.0355 29.4100
1279 CA TYR 164 0.0510 36.4106 27.8300
1291 CA LYS 165 0.0587 37.5526 33.6200
1300 CA THR 166 0.0499 36.2506 30.8300
1307 CA LEU 167 0.0562 37.1858 27.7000
1315 CA ARG 168 0.0683 38.9681 27.9100
1326 CA ALA 169 0.0717 39.4815 32.5900
1331 CA GLU 170 0.0790 40.5563 43.7300
1340 CA GLN 171 0.1273 47.6964 72.9800
1349 CA ALA 172 0.1693 53.9031 52.0500
1354 CA SER 173 0.2983 72.9684 38.7400
1360 CA GLN 174 0.2897 71.6879 47.0500
1369 CA GLU 175 0.3208 76.2922 45.5300
1378 CA VAL 176 0.2146 60.5904 35.3300
1385 CA LYS 177 0.1335 48.6150 38.3000
1394 CA ASN 178 0.1799 55.4639 36.7700
1402 CA TRP 179 0.1697 53.9610 36.2800
1416 CA MET 180 0.0920 42.4714 40.8300
1424 CA THR 181 0.0824 41.0627 49.5900
1431 CA GLU 182 0.1249 47.3341 58.4000
1440 CA THR 183 0.1132 45.6151 52.1500
1447 CA LEU 184 0.0639 38.3190 43.0900
1455 CA LEU 185 0.0379 34.4804 37.6500
1463 CA VAL 186 0.0592 37.6239 56.7800
1470 CA GLN 187 0.0840 41.2988 60.7700
1479 CA ASN 188 0.0627 38.1449 59.0000
1487 CA ALA 189 0.0630 38.1891 49.2500
1492 CA ASN 190 0.1213 46.8066 60.6300
1500 CA PRO 191 0.1991 58.2974 65.7800
1507 CA ASP 192 0.2193 61.2937 64.8400
1515 CA CYS 193 0.1324 48.4504 58.6500
1521 CA LYS 194 0.1147 45.8313 50.2600
1530 CA THR 195 0.1960 57.8398 50.7800
1537 CA ILE 196 0.1881 56.6804 57.5600
1545 CA LEU 197 0.1380 49.2773 64.9700
1553 CA LYS 198 0.1880 56.6599 51.5700
1562 CA ALA 199 0.2749 69.4997 46.9200
1567 CA LEU 200 0.2642 67.9224 54.3100
1575 CA GLY 201 0.3319 77.9259 59.1500
1579 CA PRO 202 0.3277 77.3019 74.0700
1586 CA GLY 203 0.4491 95.2440 71.9000
1590 CA ALA 204 0.2987 73.0253 61.3600
1595 CA THR 205 0.2801 70.2714 39.6900
1602 CA LEU 206 0.1772 55.0608 31.4600
1610 CA GLU 207 0.2802 70.2848 38.5600
1619 CA GLU 208 0.2583 67.0530 49.2800
1628 CA MET 209 0.1430 50.0062 41.6400
1636 CA MET 210 0.1519 51.3290 46.5700
1644 CA THR 211 0.2597 67.2543 56.5000
1651 CA ALA 212 0.2159 60.7800 47.2900
1656 CA CYS 213 0.1647 53.2248 45.8600
1662 CA GLN 214 0.2459 65.2138 67.5900
1671 CA GLY 215 0.4069 89.0140 83.5900
1675 CA VAL 216 0.2663 68.2376 87.2400

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.