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

* 1ERR monomer *

B-factor analysis for ID 2404102156053369258

Overall B-factor prediction

Correlation= 0.687 for 225 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 ALA 307 0.0390 64.2722 101.0600
7 CA LEU 308 0.0346 60.2819 99.0900
15 CA SER 309 0.0752 96.6189 94.7400
21 CA LEU 310 0.0405 65.5728 80.1700
29 CA THR 311 0.0415 66.5274 65.0900
36 CA ALA 312 0.0258 52.4852 56.3600
41 CA ASP 313 0.0352 60.8999 61.3600
49 CA GLN 314 0.0346 60.3100 63.6200
58 CA MET 315 0.0162 43.8763 54.5800
66 CA VAL 316 0.0164 44.0772 50.5100
73 CA SER 317 0.0312 57.2562 48.6700
79 CA ALA 318 0.0249 51.6444 42.7900
84 CA LEU 319 0.0126 40.6358 39.4900
92 CA LEU 320 0.0186 46.0165 48.2800
100 CA ASP 321 0.0406 65.6529 53.4500
108 CA ALA 322 0.0210 48.1610 36.6700
113 CA GLU 323 0.0161 43.8176 34.4300
122 CA PRO 324 0.0203 47.5369 37.2500
129 CA PRO 325 0.0290 55.3585 34.3900
136 CA ILE 326 0.0236 50.5104 35.9600
144 CA LEU 327 0.0207 47.8802 33.8900
152 CA TYR 328 0.0207 47.8896 38.4400
164 CA SER 329 0.0194 46.7385 51.0200
170 CA GLU 330 0.0270 53.4929 76.0100
179 CA TYR 331 0.0775 98.6768 100.4800
184 CA ASP 332 0.0978 116.7560 120.4100
189 CA PRO 333 0.0776 98.7351 130.4100
196 CA THR 334 0.0841 104.5241 129.2500
203 CA ARG 335 0.0683 90.4273 123.6800
214 CA PRO 336 0.0864 106.6204 113.4000
221 CA PHE 337 0.0377 63.1325 107.4100
232 CA SER 338 0.0510 74.9650 101.3200
238 CA GLU 339 0.0354 61.0445 97.0100
247 CA ALA 340 0.0511 75.0284 84.4000
252 CA SER 341 0.0355 61.1253 72.0200
258 CA MET 342 0.0206 47.7938 62.0100
266 CA MET 343 0.0251 51.8494 50.6300
274 CA GLY 344 0.0296 55.8611 40.8900
278 CA LEU 345 0.0185 45.9002 39.6600
286 CA LEU 346 0.0174 44.9837 38.1500
294 CA THR 347 0.0316 57.6212 38.3600
301 CA ASN 348 0.0238 50.6569 35.1200
309 CA LEU 349 0.0137 41.6454 27.9100
317 CA ALA 350 0.0182 45.6495 32.5000
322 CA ASP 351 0.0247 51.4858 36.1000
330 CA ARG 352 0.0211 48.2470 30.2700
341 CA GLU 353 0.0120 40.1787 31.6200
350 CA LEU 354 0.0120 40.1802 33.4200
358 CA VAL 355 0.0168 44.4190 29.8100
365 CA HIS 356 0.0153 43.0904 34.3000
375 CA MET 357 0.0094 37.8443 34.7200
383 CA ILE 358 0.0100 38.3572 40.6700
391 CA ASN 359 0.0129 40.9088 40.9100
399 CA TRP 360 0.0097 38.0498 36.8000
413 CA ALA 361 0.0093 37.7176 43.3100
418 CA LYS 362 0.0106 38.9051 44.0200
427 CA ARG 363 0.0125 40.5619 48.6800
438 CA VAL 364 0.0100 38.3394 47.1200
445 CA PRO 365 0.0122 40.3372 55.7100
452 CA GLY 366 0.0125 40.5678 56.3900
456 CA PHE 367 0.0105 38.8312 49.7400
467 CA VAL 368 0.0156 43.3886 55.1000
474 CA ASP 369 0.0253 52.0388 60.4700
482 CA LEU 370 0.0205 47.7689 56.1200
490 CA THR 371 0.0329 58.8048 54.2100
497 CA LEU 372 0.0235 50.4463 58.2900
505 CA HIS 373 0.0269 53.4167 65.5500
520 CA ASP 374 0.0217 48.8347 51.3800
528 CA GLN 375 0.0120 40.1802 41.6100
537 CA VAL 376 0.0138 41.7545 37.9700
544 CA HIS 377 0.0173 44.8669 46.7800
559 CA LEU 378 0.0124 40.5052 37.2900
567 CA LEU 379 0.0095 37.9032 38.2000
575 CA GLU 380 0.0155 43.2737 41.7200
584 CA ALA 382 0.0087 37.2057 40.0800
589 CA TRP 383 0.0091 37.5316 34.0900
603 CA LEU 384 0.0106 38.9211 31.2000
611 CA GLU 385 0.0086 37.0958 33.9400
620 CA ILE 386 0.0068 35.4643 34.0800
628 CA LEU 387 0.0081 36.6760 29.6100
636 CA MET 388 0.0069 35.6149 32.1100
644 CA ILE 389 0.0065 35.1999 28.0800
652 CA GLY 390 0.0085 37.0149 32.8100
656 CA LEU 391 0.0074 35.9940 37.5800
664 CA VAL 392 0.0088 37.2921 35.1700
671 CA TRP 393 0.0083 36.8254 40.6300
685 CA ARG 394 0.0113 39.5072 38.2600
696 CA SER 395 0.0102 38.5333 38.3500
702 CA MET 396 0.0136 41.5561 52.1600
710 CA GLU 397 0.0286 54.9314 64.2800
716 CA HIS 398 0.0251 51.8184 61.9900
726 CA PRO 399 0.0297 55.9128 63.4400
733 CA GLY 400 0.0255 52.2317 58.6600
737 CA LYS 401 0.0153 43.0483 61.6500
746 CA LEU 402 0.0092 37.5997 45.1000
754 CA LEU 403 0.0099 38.2991 40.5900
762 CA PHE 404 0.0099 38.2269 41.9400
773 CA ALA 405 0.0128 40.8515 42.1500
778 CA PRO 406 0.0241 50.9497 40.4300
785 CA ASN 407 0.0251 51.8008 47.1400
793 CA LEU 408 0.0140 41.9373 44.2800
801 CA LEU 409 0.0129 40.9535 53.6500
809 CA LEU 410 0.0135 41.4545 58.3000
817 CA ASP 411 0.0163 43.9749 68.1100
825 CA ARG 412 0.0235 50.3825 83.6900
836 CA ASN 413 0.0343 60.0260 88.4000
844 CA GLN 414 0.0196 46.9267 82.7900
853 CA GLY 415 0.0187 46.1219 83.4000
857 CA LYS 416 0.0257 52.4038 88.4600
862 CA CYS 417 0.0279 54.3805 93.0700
868 CA VAL 418 0.0258 52.4636 93.6200
875 CA GLU 419 0.0316 57.6203 95.5400
880 CA GLY 420 0.0274 53.9035 92.1200
884 CA MET 421 0.0188 46.2331 82.9900
892 CA VAL 422 0.0205 47.7331 71.6800
899 CA GLU 423 0.0311 57.2257 62.3400
908 CA ILE 424 0.0151 42.9469 49.9400
916 CA PHE 425 0.0112 39.4626 48.8300
927 CA ASP 426 0.0164 44.0748 52.0200
935 CA MET 427 0.0158 43.5451 41.4200
943 CA LEU 428 0.0104 38.7389 36.0300
951 CA LEU 429 0.0116 39.7418 41.2900
959 CA ALA 430 0.0172 44.7628 37.0900
964 CA THR 431 0.0126 40.6384 36.4600
971 CA SER 432 0.0115 39.6702 45.8600
977 CA SER 433 0.0163 43.9719 49.5400
983 CA ARG 434 0.0155 43.2436 45.6700
994 CA PHE 435 0.0113 39.5299 46.9100
1005 CA ARG 436 0.0185 45.9545 49.3400
1016 CA MET 437 0.0288 55.1155 57.0100
1024 CA MET 438 0.0212 48.3782 51.3700
1032 CA ASN 439 0.0285 54.8974 45.7700
1040 CA LEU 440 0.0128 40.8812 40.8500
1048 CA GLN 441 0.0178 45.3183 42.5400
1057 CA GLY 442 0.0160 43.6706 41.7500
1061 CA GLU 443 0.0124 40.4614 43.1800
1070 CA GLU 444 0.0088 37.2514 38.1100
1079 CA PHE 445 0.0075 36.0742 36.3200
1090 CA VAL 446 0.0082 36.7268 35.3900
1097 CA CYS 447 0.0068 35.5222 36.8100
1103 CA LEU 448 0.0063 35.0269 36.1900
1111 CA LYS 449 0.0064 35.0961 33.3500
1120 CA SER 450 0.0066 35.3209 32.6900
1126 CA ILE 451 0.0068 35.4924 29.6700
1134 CA ILE 452 0.0066 35.2973 25.6300
1142 CA LEU 453 0.0058 34.5943 34.0400
1150 CA LEU 454 0.0083 36.7990 35.0800
1158 CA ASN 455 0.0119 40.0439 44.6300
1166 CA SER 456 0.0134 41.3428 53.3700
1172 CA GLY 457 0.0181 45.6214 70.5400
1176 CA VAL 458 0.0358 61.3958 90.2500
1183 CA TYR 459 0.0861 106.3503 104.8000
1195 CA GLU 470 0.2040 211.5909 107.0200
1200 CA GLU 471 0.0927 112.1929 101.1600
1205 CA LYS 472 0.0754 96.7256 88.7600
1211 CA ASP 473 0.0567 80.0452 76.6300
1212 CA ASP 473 0.0568 80.1117 78.9900
1226 CA HIS 474 0.0268 53.3806 64.5900
1236 CA ILE 475 0.0192 46.5703 56.7200
1244 CA HIS 476 0.0278 54.2195 58.5900
1254 CA ARG 477 0.0283 54.7265 57.6600
1262 CA VAL 478 0.0153 43.0618 48.3100
1269 CA LEU 479 0.0154 43.2057 41.0400
1277 CA ASP 480 0.0251 51.7995 42.4100
1285 CA LYS 481 0.0177 45.2477 44.3600
1294 CA ILE 482 0.0098 38.1825 37.6700
1302 CA THR 483 0.0145 42.3698 38.4900
1309 CA ASP 484 0.0192 46.5852 43.0900
1317 CA THR 485 0.0134 41.3440 40.5700
1324 CA LEU 486 0.0106 38.9170 43.0900
1332 CA ILE 487 0.0145 42.3539 44.7600
1340 CA HIS 488 0.0216 48.6962 49.7500
1350 CA LEU 489 0.0182 45.7049 45.2400
1358 CA MET 490 0.0219 49.0149 48.2600
1366 CA ALA 491 0.0381 63.4622 52.2700
1371 CA LYS 492 0.0926 112.1680 62.6700
1377 CA ALA 493 0.1009 119.5360 60.4100
1382 CA GLY 494 0.0939 113.3321 63.7400
1386 CA LEU 495 0.0605 83.4936 58.5900
1394 CA THR 496 0.0926 112.1054 57.2900
1401 CA LEU 497 0.0828 103.4159 57.8600
1409 CA GLN 498 0.0802 101.0487 55.7400
1418 CA GLN 499 0.0509 74.8691 56.7700
1427 CA GLN 500 0.0275 54.0175 47.8300
1436 CA HIS 501 0.0401 65.1973 42.5800
1451 CA GLN 502 0.0345 60.2154 40.5500
1460 CA ARG 503 0.0194 46.7065 37.1700
1471 CA LEU 504 0.0160 43.7367 34.1400
1479 CA ALA 505 0.0221 49.1307 30.6300
1484 CA GLN 506 0.0192 46.5315 38.1900
1493 CA LEU 507 0.0142 42.1171 32.9000
1501 CA LEU 508 0.0196 46.9599 29.0800
1509 CA LEU 509 0.0278 54.2805 27.2600
1517 CA ILE 510 0.0127 40.7633 31.4000
1525 CA LEU 511 0.0127 40.7222 28.5100
1533 CA SER 512 0.0254 52.0719 34.0500
1539 CA HIS 513 0.0209 48.0487 33.8900
1549 CA ILE 514 0.0109 39.1589 31.9400
1557 CA ARG 515 0.0123 40.3753 32.9100
1568 CA HIS 516 0.0195 46.8762 36.2100
1578 CA MET 517 0.0127 40.7225 33.7900
1586 CA SER 518 0.0134 41.4100 33.2100
1592 CA ASN 519 0.0209 48.0670 33.0700
1600 CA LYS 520 0.0215 48.5830 44.5500
1609 CA GLY 521 0.0205 47.7394 39.7800
1613 CA MET 522 0.0231 50.0510 42.0800
1621 CA GLU 523 0.0335 59.3469 58.8000
1630 CA HIS 524 0.0292 55.4756 68.3600
1640 CA LEU 525 0.0318 57.8397 73.1900
1648 CA TYR 526 0.0591 82.2221 90.8100
1660 CA SER 527 0.0843 104.7339 95.4500
1666 CA MET 528 0.1091 126.8853 102.8500
1674 CA PRO 535 0.1023 120.7640 83.5900
1681 CA LEU 536 0.0409 65.9193 61.4800
1689 CA TYR 537 0.0316 57.6362 49.6000
1701 CA ASP 538 0.0423 67.2228 62.6400
1709 CA LEU 539 0.0361 61.6200 56.1100
1717 CA LEU 540 0.0204 47.6782 50.0700
1725 CA LEU 541 0.0247 51.5062 56.1800
1733 CA GLU 542 0.0368 62.3117 57.1700
1738 CA MET 543 0.0247 51.4861 60.0400
1746 CA LEU 544 0.0183 45.7273 62.8600
1754 CA ASP 545 0.0489 73.1261 84.8900
1762 CA ALA 546 0.0866 106.7479 94.0500
1767 CA HIS 547 0.0656 88.0143 99.0600

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.