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

* 7dfr *

B-factor analysis for ID 2404041950582372311

Overall B-factor prediction

Correlation= 0.348 for 159 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 0.0056 41.3626 55.6900
21 CA ILE 2 0.0022 37.2352 48.4900
40 CA SER 3 0.0015 36.4442 42.0700
51 CA LEU 4 0.0013 36.2057 44.2300
70 CA ILE 5 0.0013 36.1752 31.7100
89 CA ALA 6 0.0014 36.3311 29.2400
99 CA ALA 7 0.0019 36.8193 29.7700
109 CA LEU 8 0.0020 37.0260 35.4200
128 CA ALA 9 0.0030 38.1856 36.8500
138 CA VAL 10 0.0074 43.4915 46.6100
154 CA ASP 11 0.0093 45.7722 49.1800
166 CA ARG 12 0.0039 39.3138 45.8200
190 CA VAL 13 0.0035 38.7800 38.4600
206 CA ILE 14 0.0027 37.8694 39.3100
225 CA GLY 15 0.0051 40.6843 36.7700
232 CA MET 16 0.0091 45.4934 52.2900
249 CA GLU 17 0.0235 62.8673 61.5600
264 CA ASN 18 0.0127 49.8775 62.0100
278 CA ALA 19 0.0131 50.3367 57.9000
288 CA MET 20 0.0064 42.2728 50.4700
305 CA PRO 21 0.0063 42.1651 48.2500
319 CA TRP 22 0.0052 40.8501 41.2300
343 CA ASN 23 0.0093 45.7589 46.4900
357 CA LEU 24 0.0048 40.3304 32.1900
376 CA PRO 25 0.0094 45.9286 27.1300
390 CA ALA 26 0.0053 40.9565 29.5700
400 CA ASP 27 0.0029 38.0234 29.5200
412 CA LEU 28 0.0048 40.3216 34.7400
431 CA ALA 29 0.0055 41.1664 33.9300
441 CA TRP 30 0.0029 38.0297 33.9200
465 CA PHE 31 0.0026 37.7019 38.5200
485 CA LYS 32 0.0038 39.2154 41.0100
507 CA ARG 33 0.0052 40.7897 44.6500
531 CA ASN 34 0.0027 37.8383 41.4000
545 CA THR 35 0.0024 37.5073 40.1000
559 CA LEU 36 0.0043 39.7420 41.7900
578 CA ASP 37 0.0082 44.4141 41.9200
590 CA LYS 38 0.0030 38.1724 39.4700
612 CA PRO 39 0.0022 37.2584 38.8500
626 CA VAL 40 0.0015 36.4061 35.5900
642 CA ILE 41 0.0012 36.0682 37.1700
661 CA MET 42 0.0016 36.5055 40.2800
678 CA GLY 43 0.0023 37.3621 44.2200
685 CA ARG 44 0.0041 39.5344 45.1400
709 CA HIS 45 0.0056 41.3092 43.3900
726 CA THR 46 0.0036 38.9481 38.0800
740 CA TRP 47 0.0035 38.7728 41.1700
764 CA GLU 48 0.0065 42.4409 44.5200
779 CA SER 49 0.0105 47.1875 46.0500
790 CA ILE 50 0.0065 42.4365 36.8500
809 CA GLY 51 0.0125 49.5964 40.9900
816 CA ARG 52 0.0098 46.4197 43.1300
840 CA PRO 53 0.0057 41.3910 35.4100
854 CA LEU 54 0.0041 39.5251 36.2900
873 CA PRO 55 0.0115 48.4077 36.0200
887 CA GLY 56 0.0093 45.7504 34.2800
894 CA ARG 57 0.0037 39.0059 38.6500
918 CA LYS 58 0.0029 38.0805 40.3500
940 CA ASN 59 0.0021 37.1023 40.7100
954 CA ILE 60 0.0017 36.5923 40.9700
973 CA ILE 61 0.0018 36.7484 40.4100
992 CA LEU 62 0.0023 37.3345 45.7500
1011 CA SER 63 0.0052 40.8763 51.4500
1022 CA SER 64 0.0150 52.6228 57.4400
1033 CA GLN 65 0.0163 54.2112 59.1100
1050 CA PRO 66 0.0191 57.4884 60.7900
1064 CA GLY 67 0.0091 45.5711 59.6800
1071 CA THR 68 0.0152 52.9011 53.4000
1085 CA ASP 69 0.0109 47.6432 45.7200
1097 CA ASP 70 0.0240 63.4348 47.6700
1109 CA ARG 71 0.0142 51.6633 42.7100
1133 CA VAL 72 0.0045 40.0404 43.7500
1149 CA THR 73 0.0034 38.6793 42.4100
1163 CA TRP 74 0.0034 38.7143 43.5000
1187 CA VAL 75 0.0034 38.7125 42.8000
1203 CA LYS 76 0.0079 44.1057 53.9500
1225 CA SER 77 0.0078 43.9987 51.1700
1236 CA VAL 78 0.0038 39.2012 50.3700
1252 CA ASP 79 0.0084 44.6491 55.6900
1264 CA GLU 80 0.0059 41.6880 51.9800
1279 CA ALA 81 0.0028 37.9278 47.3900
1289 CA ILE 82 0.0037 38.9797 48.1500
1308 CA ALA 83 0.0088 45.2116 54.1800
1318 CA ALA 84 0.0045 40.0289 49.5900
1328 CA CYS 85 0.0043 39.7151 54.3100
1339 CA GLY 86 0.0250 64.6636 59.3900
1346 CA ASP 87 0.0519 96.8986 64.7000
1358 CA VAL 88 0.0129 50.1295 59.8900
1374 CA PRO 89 0.0158 53.5584 53.1500
1388 CA GLU 90 0.0033 38.5877 43.6700
1403 CA ILE 91 0.0021 37.0740 41.9300
1422 CA MET 92 0.0014 36.2844 39.5300
1439 CA VAL 93 0.0013 36.1598 37.9800
1455 CA ILE 94 0.0015 36.4053 31.0000
1474 CA GLY 95 0.0019 36.8172 29.0500
1481 CA GLY 96 0.0027 37.8900 31.0700
1488 CA GLY 97 0.0034 38.7226 36.2900
1495 CA ARG 98 0.0048 40.3371 36.5000
1519 CA VAL 99 0.0021 37.0788 34.3000
1535 CA TYR 100 0.0019 36.8172 40.3100
1556 CA GLU 101 0.0036 38.8613 49.3800
1571 CA GLN 102 0.0037 38.9859 52.1100
1588 CA PHE 103 0.0020 36.9573 47.7100
1608 CA LEU 104 0.0023 37.3186 45.1100
1627 CA PRO 105 0.0054 41.0642 45.1500
1641 CA LYS 106 0.0040 39.3645 50.6100
1663 CA ALA 107 0.0022 37.2854 47.9500
1673 CA GLN 108 0.0028 37.9761 52.4800
1690 CA LYS 109 0.0019 36.8980 47.6600
1712 CA LEU 110 0.0015 36.3729 43.1300
1731 CA TYR 111 0.0015 36.3997 34.9900
1752 CA LEU 112 0.0015 36.4110 29.3700
1771 CA THR 113 0.0018 36.7242 25.5200
1785 CA HIS 114 0.0024 37.4455 26.3300
1802 CA ILE 115 0.0027 37.8063 34.4900
1821 CA ASP 116 0.0064 42.2471 39.3500
1833 CA ALA 117 0.0067 42.6428 41.0800
1843 CA GLU 118 0.0128 49.9900 47.8200
1858 CA VAL 119 0.0082 44.4699 43.7100
1874 CA GLU 120 0.0137 51.0937 49.2100
1889 CA GLY 121 0.0072 43.2423 50.6200
1896 CA ASP 122 0.0120 49.0092 48.1700
1908 CA THR 123 0.0057 41.3975 42.3900
1922 CA HIS 124 0.0043 39.7281 37.8600
1939 CA PHE 125 0.0023 37.3553 37.5100
1959 CA PRO 126 0.0029 38.0401 48.1800
1973 CA ASP 127 0.0079 44.0750 56.2200
1985 CA TYR 128 0.0035 38.8106 54.8900
2006 CA GLU 129 0.0139 51.2963 58.6700
2021 CA PRO 130 0.0155 53.2319 57.3300
2035 CA ASP 131 0.0267 66.7095 60.1500
2047 CA ASP 132 0.0099 46.4664 61.6000
2059 CA TRP 133 0.0041 39.5284 52.8100
2083 CA GLU 134 0.0078 43.9529 51.8400
2098 CA SER 135 0.0063 42.2009 43.5000
2109 CA VAL 136 0.0080 44.2466 36.0400
2125 CA PHE 137 0.0075 43.5808 32.7400
2145 CA SER 138 0.0078 43.9037 34.8700
2156 CA GLU 139 0.0078 43.9840 35.9300
2171 CA PHE 140 0.0105 47.1710 28.2800
2191 CA HIS 141 0.0076 43.7605 27.9900
2208 CA ASP 142 0.0145 52.0479 36.0500
2220 CA ALA 143 0.0114 48.3037 29.6000
2230 CA ASP 144 0.0263 66.2038 30.2500
2242 CA ALA 145 0.0586 104.9631 36.0800
2252 CA GLN 146 0.0243 63.7784 45.7700
2269 CA ASN 147 0.0085 44.7635 38.0700
2283 CA SER 148 0.0111 47.8882 34.0900
2294 CA HIS 149 0.0061 41.9183 29.9800
2311 CA SER 150 0.0059 41.7136 27.7900
2322 CA TYR 151 0.0035 38.8109 30.3600
2343 CA CYS 152 0.0036 38.8684 32.7900
2354 CA PHE 153 0.0025 37.6436 32.5200
2374 CA GLU 154 0.0027 37.7831 34.0400
2389 CA ILE 155 0.0026 37.6733 38.5200
2408 CA LEU 156 0.0025 37.5570 46.2800
2427 CA GLU 157 0.0038 39.1439 51.5600
2442 CA ARG 158 0.0043 39.7765 55.1500
2466 CA ARG 159 0.0147 52.2693 66.6700

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.