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

* 3ZXF *

B-factor analysis for ID 2403281306111137963

Overall B-factor prediction

Correlation= 0.295 for 278 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 SER 1 0.2833 23.9831 33.4500
8 CA ASN 2 0.0995 20.2914 23.7100
16 CA VAL 3 0.0944 20.1898 23.9600
23 CA PRO 4 0.0418 19.1332 23.4100
30 CA HIS 5 0.0254 18.8037 16.2600
40 CA LYS 6 0.0248 18.7920 15.5800
49 CA SER 7 0.0258 18.8115 18.0100
55 CA SER 8 0.0329 18.9559 18.8800
61 CA LEU 9 0.0353 19.0036 17.3800
69 CA PRO 10 0.0676 19.6507 23.2700
76 CA GLU 11 0.1005 20.3128 21.2000
85 CA GLY 12 0.0402 19.1016 15.9700
89 CA ILE 13 0.0164 18.6232 17.8100
97 CA ARG 14 0.0158 18.6111 19.6900
108 CA PRO 15 0.0114 18.5240 17.0900
115 CA GLY 16 0.0101 18.4971 18.8700
119 CA THR 17 0.0095 18.4853 18.7400
126 CA VAL 18 0.0090 18.4761 15.2800
133 CA LEU 19 0.0094 18.4838 13.1800
141 CA ARG 20 0.0098 18.4913 12.9700
152 CA ILE 21 0.0106 18.5071 12.9500
160 CA ARG 22 0.0146 18.5875 11.7700
171 CA GLY 23 0.0253 18.8031 12.6700
175 CA LEU 24 0.0277 18.8505 12.2800
183 CA VAL 25 0.0260 18.8159 11.8200
190 CA PRO 26 0.0391 19.0798 12.7800
197 CA PRO 27 0.0720 19.7391 15.3700
204 CA ASN 28 0.0803 19.9066 18.2000
212 CA ALA 29 0.0352 19.0010 13.3300
217 CA SER 30 0.0333 18.9636 13.2600
223 CA ARG 31 0.0175 18.6453 12.0400
234 CA PHE 32 0.0134 18.5632 10.6400
245 CA HIS 33 0.0081 18.4562 12.0600
255 CA VAL 34 0.0064 18.4237 11.7400
262 CA ASN 35 0.0070 18.4353 11.6900
270 CA LEU 36 0.0076 18.4472 10.8700
278 CA LEU 37 0.0142 18.5800 12.0900
286 CA GLY 39 0.0422 19.1411 17.7800
290 CA GLU 40 0.0506 19.3112 19.1400
299 CA GLU 41 0.0916 20.1338 21.8600
308 CA GLN 42 0.1054 20.4111 24.4600
317 CA GLY 43 0.1089 20.4811 21.7300
321 CA SER 44 0.0460 19.2185 15.5200
327 CA ASP 45 0.0247 18.7897 13.2900
335 CA ALA 46 0.0146 18.5878 12.4000
340 CA ALA 47 0.0093 18.4819 12.2600
345 CA LEU 48 0.0064 18.4220 10.4000
353 CA HIS 49 0.0072 18.4393 10.4500
363 CA PHE 50 0.0053 18.4017 10.3300
374 CA ASN 51 0.0089 18.4736 10.7200
382 CA PRO 52 0.0104 18.5035 11.1700
389 CA ARG 53 0.0180 18.6553 11.7800
400 CA LEU 54 0.0254 18.8048 13.2500
408 CA ASP 55 0.0444 19.1855 13.6300
416 CA THR 56 0.0482 19.2626 12.9400
423 CA SER 57 0.0366 19.0285 12.4800
429 CA GLU 58 0.0246 18.7883 13.6600
438 CA VAL 59 0.0128 18.5507 11.3300
445 CA VAL 60 0.0123 18.5411 11.4100
452 CA PHE 61 0.0089 18.4741 11.7800
463 CA ASN 62 0.0117 18.5291 10.2300
471 CA SER 63 0.0151 18.5972 11.4200
477 CA LYS 64 0.0216 18.7284 13.5500
486 CA GLU 65 0.0359 19.0148 18.7500
495 CA GLN 66 0.0756 19.8123 20.9000
504 CA GLY 67 0.0695 19.6894 17.0400
508 CA SER 68 0.0731 19.7616 16.1200
514 CA TRP 69 0.0376 19.0500 12.8000
528 CA GLY 70 0.0393 19.0835 13.4200
532 CA ARG 71 0.0432 19.1616 11.7100
543 CA GLU 72 0.0253 18.8015 12.7600
552 CA GLU 73 0.0179 18.6531 13.3900
561 CA ARG 74 0.0187 18.6698 14.8600
572 CA GLY 75 0.0191 18.6785 15.4000
576 CA PRO 76 0.0318 18.9326 21.8900
583 CA GLY 77 0.0345 18.9881 22.2400
587 CA VAL 78 0.0267 18.8310 16.8400
594 CA PRO 79 0.0234 18.7637 15.5800
601 CA PHE 80 0.0220 18.7355 15.6200
612 CA GLN 81 0.0454 19.2060 16.5800
621 CA ARG 82 0.0414 19.1259 15.0300
632 CA GLY 83 0.0589 19.4774 13.7000
636 CA GLN 84 0.0545 19.3894 13.9200
645 CA PRO 85 0.0358 19.0124 12.6700
652 CA PHE 86 0.0230 18.7569 11.0000
663 CA GLU 87 0.0116 18.5275 13.1400
672 CA VAL 88 0.0093 18.4804 12.5600
680 CA LEU 89 0.0081 18.4566 12.2500
681 CA LEU 89 0.0081 18.4565 15.0300
695 CA ILE 90 0.0073 18.4419 14.4300
703 CA ILE 91 0.0082 18.4598 14.5200
711 CA ALA 92 0.0088 18.4705 15.8400
716 CA SER 93 0.0122 18.5397 17.9900
722 CA ASP 94 0.0174 18.6437 22.4400
730 CA ASP 95 0.0256 18.8080 21.2600
738 CA GLY 96 0.0135 18.5662 18.4100
742 CA PHE 97 0.0076 18.4473 15.8100
753 CA LYS 98 0.0088 18.4709 15.6200
762 CA ALA 99 0.0085 18.4656 14.2400
767 CA VAL 100 0.0098 18.4912 14.6700
774 CA VAL 101 0.0116 18.5279 15.6000
781 CA GLY 102 0.0152 18.5998 21.5900
785 CA ASP 103 0.0202 18.6991 26.5600
793 CA ALA 104 0.0198 18.6919 22.2600
798 CA GLN 105 0.0161 18.6169 16.8300
807 CA TYR 106 0.0125 18.5453 15.4900
819 CA HIS 107 0.0146 18.5873 15.9600
829 CA HIS 108 0.0131 18.5582 16.8700
839 CA PHE 109 0.0130 18.5555 15.2900
851 CA ARG 110 0.0168 18.6317 15.7500
852 CA ARG 110 0.0167 18.6300 16.7500
872 CA HIS 111 0.0141 18.5775 15.4400
882 CA ARG 112 0.0166 18.6287 14.9600
893 CA LEU 113 0.0200 18.6964 16.8400
901 CA PRO 114 0.0246 18.7879 17.0600
908 CA LEU 115 0.0150 18.5960 16.0400
916 CA ALA 116 0.0220 18.7371 17.4600
922 CA ARG 117 0.0233 18.7621 13.6000
923 CA ARG 117 0.0230 18.7570 14.9300
943 CA VAL 118 0.0171 18.6375 13.5700
950 CA ARG 119 0.0248 18.7914 13.7200
961 CA LEU 120 0.0183 18.6628 14.0600
969 CA VAL 121 0.0120 18.5348 12.5300
976 CA GLU 122 0.0130 18.5559 12.3200
985 CA VAL 123 0.0119 18.5334 14.1200
992 CA GLY 124 0.0149 18.5941 16.8400
996 CA GLY 125 0.0248 18.7916 13.5000
1000 CA ASP 126 0.0244 18.7843 12.3800
1008 CA VAL 127 0.0210 18.7160 11.6800
1015 CA GLN 128 0.0310 18.9170 11.2000
1024 CA LEU 129 0.0236 18.7682 12.7900
1032 CA ASP 130 0.0349 18.9947 12.3800
1040 CA SER 131 0.0203 18.7013 12.9100
1046 CA VAL 132 0.0161 18.6174 13.7600
1053 CA ARG 133 0.0149 18.5934 15.5400
1064 CA ILE 134 0.0140 18.5745 16.9400
1072 CA PHE 135 0.0116 18.5264 18.5600
1084 CA PRO -2 5.2156 123.0059 43.5500
1091 CA ALA -1 3.1028 80.5871 37.0100
1096 CA MET 0 1.0145 38.6617 33.6900
1104 CA SER 1 0.4032 26.3891 28.7500
1110 CA ASN 2 0.1225 20.7538 29.9500
1118 CA VAL 3 0.1226 20.7550 29.3300
1125 CA PRO 4 0.0351 18.9990 24.7700
1132 CA HIS 5 0.0255 18.8072 18.7600
1142 CA LYS 6 0.0233 18.7627 17.0600
1151 CA SER 7 0.0240 18.7754 19.5900
1157 CA SER 8 0.0295 18.8876 22.4700
1163 CA LEU 9 0.0263 18.8225 27.4500
1171 CA PRO 10 0.0722 19.7437 39.4700
1178 CA GLU 11 0.0586 19.4704 41.3400
1187 CA GLY 12 0.0295 18.8868 38.6900
1191 CA ILE 13 0.0205 18.7058 27.9000
1199 CA ARG 14 0.0195 18.6862 22.1900
1210 CA PRO 15 0.0131 18.5568 19.9300
1217 CA GLY 16 0.0105 18.5054 18.1100
1221 CA THR 17 0.0106 18.5063 17.3500
1229 CA VAL 18 0.0095 18.4849 13.4900
1230 CA VAL 18 0.0095 18.4846 16.2600
1242 CA LEU 19 0.0093 18.4812 14.1100
1250 CA ARG 20 0.0099 18.4938 13.8000
1261 CA ILE 21 0.0103 18.5018 15.2800
1269 CA ARG 22 0.0155 18.6048 15.0400
1280 CA GLY 23 0.0200 18.6961 16.8300
1284 CA LEU 24 0.0283 18.8621 18.5900
1292 CA VAL 25 0.0246 18.7878 18.7900
1299 CA PRO 26 0.0430 19.1580 20.5100
1306 CA PRO 27 0.0636 19.5716 26.9700
1313 CA ASN 28 0.0726 19.7512 29.1800
1321 CA ALA 29 0.0378 19.0536 25.7400
1326 CA SER 30 0.0317 18.9305 26.9300
1332 CA ARG 31 0.0205 18.7057 23.8700
1343 CA PHE 32 0.0118 18.5324 19.5200
1354 CA HIS 33 0.0095 18.4851 18.4700
1364 CA VAL 34 0.0072 18.4390 16.5200
1371 CA ASN 35 0.0078 18.4519 16.6400
1379 CA LEU 36 0.0089 18.4725 15.8200
1387 CA LEU 37 0.0123 18.5421 16.1000
1395 CA GLY 39 0.0466 19.2294 29.5200
1399 CA GLU 40 0.0576 19.4515 35.6500
1408 CA GLU 41 0.1092 20.4875 39.6800
1417 CA GLN 42 0.1160 20.6234 40.5300
1426 CA GLY 43 0.0871 20.0429 37.3400
1430 CA SER 44 0.0482 19.2612 32.0400
1436 CA ASP 45 0.0258 18.8127 25.4700
1444 CA ALA 46 0.0155 18.6047 20.6500
1449 CA ALA 47 0.0100 18.4962 17.5200
1454 CA LEU 48 0.0071 18.4373 16.4300
1462 CA HIS 49 0.0080 18.4559 17.2800
1472 CA PHE 50 0.0065 18.4259 17.1400
1483 CA ASN 51 0.0102 18.4996 19.8500
1491 CA PRO 52 0.0119 18.5334 20.3800
1498 CA ARG 53 0.0193 18.6816 23.4200
1509 CA LEU 54 0.0260 18.8162 24.7100
1517 CA ASP 55 0.0448 19.1931 29.1700
1525 CA THR 56 0.0460 19.2171 31.1800
1532 CA SER 57 0.0370 19.0364 30.3400
1538 CA GLU 58 0.0251 18.7984 27.0800
1547 CA VAL 59 0.0143 18.5816 24.7900
1554 CA VAL 60 0.0137 18.5695 23.5900
1561 CA PHE 61 0.0103 18.5019 22.4300
1572 CA ASN 62 0.0127 18.5485 20.7700
1580 CA SER 63 0.0163 18.6209 24.1000
1586 CA LYS 64 0.0224 18.7439 27.6100
1595 CA GLU 65 0.0405 19.1081 42.4800
1604 CA GLN 66 0.0830 19.9612 49.7700
1613 CA GLY 67 0.0778 19.8556 43.6100
1617 CA SER 68 0.0707 19.7139 38.9200
1623 CA TRP 69 0.0352 19.0003 33.9200
1637 CA GLY 70 0.0351 18.9982 35.7400
1642 CA ARG 71 0.0394 19.0858 37.4200
1643 CA ARG 71 0.0391 19.0789 37.1000
1663 CA GLU 72 0.0254 18.8045 32.4700
1672 CA GLU 73 0.0197 18.6898 26.7700
1681 CA ARG 74 0.0231 18.7576 34.4200
1692 CA GLY 75 0.0284 18.8649 36.3000
1696 CA PRO 76 0.0465 19.2272 36.3300
1703 CA GLY 77 0.0358 19.0138 30.3200
1707 CA VAL 78 0.0258 18.8123 25.7000
1714 CA PRO 79 0.0227 18.7506 22.6700
1721 CA PHE 80 0.0215 18.7259 19.5400
1732 CA GLN 81 0.0424 19.1454 23.9300
1741 CA ARG 82 0.0413 19.1239 21.7600
1752 CA GLY 83 0.0547 19.3932 19.9400
1756 CA GLN 84 0.0501 19.3012 18.7900
1765 CA PRO 85 0.0339 18.9755 19.9000
1772 CA PHE 86 0.0236 18.7684 16.3000
1783 CA GLU 87 0.0121 18.5383 13.8300
1792 CA VAL 88 0.0105 18.5061 14.1500
1799 CA LEU 89 0.0082 18.4593 13.6200
1807 CA ILE 90 0.0077 18.4500 15.8400
1815 CA ILE 91 0.0089 18.4732 15.5700
1823 CA ALA 92 0.0095 18.4859 16.3600
1828 CA SER 93 0.0122 18.5395 21.1700
1834 CA ASP 94 0.0170 18.6349 24.7400
1843 CA ASP 95 0.0236 18.7674 23.7600
1844 CA ASP 95 0.0236 18.7680 23.2300
1858 CA GLY 96 0.0144 18.5828 20.4200
1862 CA PHE 97 0.0084 18.4629 16.9700
1873 CA LYS 98 0.0095 18.4862 16.6200
1882 CA ALA 99 0.0094 18.4839 15.3900
1887 CA VAL 100 0.0105 18.5049 15.0400
1894 CA VAL 101 0.0135 18.5655 15.5500
1901 CA GLY 102 0.0169 18.6334 18.1500
1905 CA ASP 103 0.0262 18.8205 18.4600
1913 CA ALA 104 0.0215 18.7256 21.6200
1918 CA GLN 105 0.0159 18.6132 21.5200
1927 CA TYR 106 0.0136 18.5671 20.5600
1939 CA HIS 107 0.0150 18.5948 20.5400
1949 CA HIS 108 0.0133 18.5612 21.6700
1959 CA PHE 109 0.0140 18.5750 18.4700
1970 CA ARG 110 0.0181 18.6579 19.4300
1981 CA HIS 111 0.0147 18.5900 23.2700
1991 CA ARG 112 0.0181 18.6572 22.8800
2002 CA LEU 113 0.0216 18.7277 24.2800
2010 CA PRO 114 0.0283 18.8617 22.9100
2017 CA LEU 115 0.0175 18.6455 22.0700
2025 CA ALA 116 0.0241 18.7779 22.5600
2030 CA ARG 117 0.0250 18.7962 19.8000
2041 CA VAL 118 0.0168 18.6317 18.8300
2048 CA ARG 119 0.0220 18.7370 21.1500
2059 CA LEU 120 0.0177 18.6505 18.5300
2067 CA VAL 121 0.0123 18.5421 14.6500
2074 CA GLU 122 0.0125 18.5456 16.6800
2083 CA VAL 123 0.0127 18.5499 16.9300
2090 CA GLY 124 0.0152 18.5989 22.4500
2094 CA GLY 125 0.0219 18.7336 21.3000
2098 CA ASP 126 0.0228 18.7531 21.7500
2106 CA VAL 127 0.0201 18.6984 17.9100
2113 CA GLN 128 0.0273 18.8427 20.1700
2122 CA LEU 129 0.0223 18.7425 18.7000
2130 CA ASP 130 0.0266 18.8292 18.8200
2138 CA SER 131 0.0192 18.6802 18.5900
2144 CA VAL 132 0.0158 18.6118 16.7400
2152 CA ARG 133 0.0146 18.5884 17.9100
2153 CA ARG 133 0.0148 18.5916 18.8500
2173 CA ILE 134 0.0140 18.5759 18.7800
2181 CA PHE 135 0.0116 18.5276 22.7700

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.