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

* EXP_4L79_unrelaxed_rank_001_alphafold2_ptm_model_4_seed_000 *

B-factor analysis for ID 24021912371233467

Overall B-factor prediction

Correlation= -0.168 for 147 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 ASP 1 1.0919 95.8578 48.0600
10 CA GLN 2 0.8696 90.6183 58.4700
19 CA LEU 3 0.6079 84.4526 68.2500
27 CA THR 4 0.9451 92.3984 77.6200
34 CA GLU 5 1.0310 94.4217 80.0600
43 CA GLU 6 1.1327 96.8184 75.3100
52 CA GLN 7 0.7556 87.9318 71.6900
61 CA ILE 8 0.5808 83.8139 81.0000
69 CA ALA 9 0.8236 89.5337 81.8800
74 CA GLU 10 0.7958 88.8801 79.0000
83 CA PHE 11 0.4566 80.8872 81.4400
94 CA LYS 12 0.5174 82.3200 83.5600
103 CA GLU 13 0.7609 88.0572 85.3100
112 CA ALA 14 0.5638 83.4118 83.0600
117 CA PHE 15 0.3601 78.6124 85.9400
128 CA SER 16 0.5961 84.1748 87.8800
134 CA LEU 17 0.6984 86.5837 85.0000
142 CA PHE 18 0.4541 80.8268 85.8100
153 CA ASP 19 0.4812 81.4654 90.0000
161 CA LYS 20 0.8000 88.9792 85.5000
170 CA ASP 21 0.9476 92.4565 90.3800
178 CA GLY 22 0.8332 89.7602 88.6900
182 CA ASP 23 0.7543 87.9028 92.6900
190 CA GLY 24 0.4882 81.6299 90.7500
194 CA THR 25 0.3179 77.6182 92.7500
201 CA ILE 26 0.2406 75.7958 92.0600
209 CA THR 27 0.3396 78.1298 92.5000
216 CA THR 28 0.3934 79.3978 90.8100
223 CA LYS 29 0.6107 84.5183 90.9400
232 CA GLU 30 0.5089 82.1187 91.6900
241 CA LEU 31 0.3833 79.1601 87.2500
249 CA GLY 32 0.6284 84.9341 86.6900
253 CA THR 33 0.8517 90.1966 87.3100
260 CA VAL 34 0.7629 88.1041 81.3100
267 CA MET 35 0.8041 89.0743 78.5000
275 CA ARG 36 1.1823 97.9886 80.8100
286 CA SER 37 1.4230 103.6596 73.9400
292 CA LEU 38 1.4320 103.8720 70.8100
300 CA GLY 39 1.7664 111.7512 71.9400
304 CA GLN 40 1.3356 101.6012 79.6900
313 CA ASN 41 1.3248 101.3461 87.3800
321 CA PRO 42 0.9457 92.4114 85.1200
328 CA THR 43 1.0259 94.3010 90.0600
335 CA GLU 44 0.8260 89.5910 89.8100
344 CA ALA 45 0.8329 89.7541 89.4400
349 CA GLU 46 0.6657 85.8134 82.8100
358 CA LEU 47 0.4374 80.4329 87.1200
366 CA GLN 48 0.4347 80.3705 89.1900
375 CA ASP 49 0.4483 80.6917 86.8800
383 CA MET 50 0.2655 76.3824 84.0600
391 CA ILE 51 0.1791 74.3465 87.3800
399 CA ASN 52 0.3040 77.2906 88.0600
407 CA GLU 53 0.2538 76.1061 82.9400
416 CA VAL 54 0.1345 73.2949 82.3800
423 CA ASP 55 0.2205 75.3215 88.4400
431 CA ALA 56 0.3978 79.5018 84.0600
436 CA ASP 57 0.5946 84.1386 88.2500
444 CA GLY 58 0.6033 84.3423 87.4400
448 CA ASN 59 0.5974 84.2051 89.8800
456 CA GLY 60 0.4240 80.1182 88.3800
460 CA THR 61 0.2604 76.2622 91.2500
467 CA ILE 62 0.1254 73.0817 91.5000
475 CA ASP 63 0.1910 74.6277 92.3800
483 CA PHE 64 0.2028 74.9052 87.2500
494 CA PRO 65 0.2162 75.2212 87.2500
501 CA GLU 66 0.1148 72.8313 87.6200
510 CA PHE 67 0.0822 72.0636 84.1200
521 CA LEU 68 0.1625 73.9562 82.3800
529 CA THR 69 0.1511 73.6870 81.3100
536 CA MET 70 0.1034 72.5622 77.1900
544 CA MET 71 0.1874 74.5430 75.9400
552 CA ALA 72 0.2528 76.0827 71.9400
557 CA ARG 73 0.2498 76.0132 69.1200
568 CA LYS 74 0.2805 76.7354 66.6200
577 CA MET 75 0.3602 78.6146 64.6900
585 CA LYS 76 0.3626 78.6705 61.6900
594 CA ASP 77 0.3632 78.6846 57.5600
602 CA THR 78 0.3765 78.9996 55.7800
609 CA ASP 79 0.3443 78.2389 59.1900
617 CA SER 80 0.4127 79.8529 65.1200
623 CA GLU 81 0.3935 79.3988 72.1900
632 CA GLU 82 0.5372 82.7853 74.3800
641 CA GLU 83 0.4255 80.1540 74.7500
650 CA ILE 84 0.2503 76.0250 82.5600
658 CA ARG 85 0.3352 78.0258 84.0600
669 CA GLU 86 0.4810 81.4621 85.6200
678 CA ALA 87 0.3342 78.0015 85.2500
683 CA PHE 88 0.2151 75.1956 89.2500
694 CA ARG 89 0.4176 79.9664 88.7500
705 CA VAL 90 0.5128 82.2116 87.9400
712 CA PHE 91 0.3312 77.9310 89.3100
723 CA ASP 92 0.3392 78.1192 91.6200
731 CA LYS 93 0.6228 84.8035 88.3100
740 CA ASP 94 0.7392 87.5456 92.0000
748 CA GLY 95 0.6570 85.6080 90.5000
752 CA ASN 96 0.6013 84.2973 93.4400
760 CA GLY 97 0.3972 79.4865 92.5600
764 CA TYR 98 0.2382 75.7391 94.1900
776 CA ILE 99 0.1710 74.1553 94.1900
784 CA SER 100 0.2822 76.7762 93.7500
790 CA ALA 101 0.4096 79.7795 92.1200
795 CA ALA 102 0.5892 84.0109 91.7500
800 CA GLU 103 0.4499 80.7293 92.0600
809 CA LEU 104 0.4000 79.5529 90.0000
817 CA ARG 105 0.7148 86.9711 89.2500
828 CA HIS 106 0.8726 90.6885 87.5000
838 CA VAL 107 0.7543 87.9015 87.1200
845 CA MET 108 0.8925 91.1573 87.0600
853 CA THR 109 1.3284 101.4307 83.7500
860 CA ASN 110 1.4854 105.1301 77.8800
868 CA LEU 111 1.4692 104.7485 78.1900
876 CA GLY 112 1.9575 116.2567 81.3100
880 CA GLU 113 1.5960 107.7371 83.0600
889 CA LYS 114 1.7514 111.3989 83.3100
898 CA LEU 115 1.3352 101.5900 85.0600
906 CA THR 116 1.5038 105.5637 89.6200
913 CA ASP 117 1.1799 97.9306 88.6900
921 CA GLU 118 1.2668 99.9787 90.1200
930 CA GLU 119 1.0854 95.7052 89.6900
939 CA VAL 120 0.6942 86.4852 90.3800
946 CA ASP 121 0.6828 86.2164 90.4400
954 CA GLU 122 0.7817 88.5466 90.8100
963 CA MET 123 0.5011 81.9344 88.8100
971 CA ILE 124 0.3278 77.8499 90.4400
979 CA ARG 125 0.5240 82.4752 91.0000
990 CA GLU 126 0.5109 82.1653 88.6900
999 CA ALA 127 0.2665 76.4055 88.3100
1004 CA ASP 128 0.3300 77.9023 91.8100
1012 CA ILE 129 0.5412 82.8798 88.6900
1020 CA ASP 130 0.7058 86.7596 91.1900
1028 CA GLY 131 0.7054 86.7501 90.5000
1032 CA ASP 132 0.6031 84.3382 91.8100
1040 CA GLY 133 0.4586 80.9324 90.9400
1044 CA GLN 134 0.2581 76.2078 93.4400
1053 CA VAL 135 0.1394 73.4110 94.1900
1060 CA ASN 136 0.1934 74.6829 93.6200
1068 CA TYR 137 0.1864 74.5195 89.9400
1080 CA GLU 138 0.2713 76.5186 89.5600
1089 CA GLU 139 0.1817 74.4073 90.6200
1098 CA PHE 140 0.0862 72.1583 88.6900
1109 CA VAL 141 0.1458 73.5626 86.4400
1116 CA GLN 142 0.2396 75.7733 84.7500
1125 CA MET 143 0.1914 74.6357 83.6200
1133 CA MET 144 0.1859 74.5060 80.3800
1141 CA THR 145 0.2912 76.9884 75.9400
1148 CA ALA 146 0.5196 82.3706 69.4400
1153 CA LYS 147 1.0080 93.8791 44.3800

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.