hlaCallsGranthamDistance calculate Grantham distance between two HLA alleles of a given, using original formula by Grantham R. 1974..

hlaCallsGranthamDistance(
  hla_calls,
  genes = c("A", "B", "C"),
  aa_selection = "binding_groove"
)

Arguments

hla_calls

HLA calls data frame, as returned by readHlaCalls function.

genes

Character vector specifying genes for which allelic distance should be calculated.

aa_selection

String specifying variable region in peptide binding groove which should be considered for Grantham distance calculation. Valid choices includes: "binding_groove", "B_pocket", "F_pocket". See details for more information.

Value

Data frame of normalized Grantham distances between pairs of alleles for each specified HLA gene. First column (ID) is the same as in

hla_calls, further columns are named as given by genes.

Details

Grantham distance is calculated only for class I HLA alleles. First exons forming the variable region in the peptide binding groove are selected. Here we provide option to choose either "binding_groove" - exon 2 and 3 (positions 1-182 in IMGT/HLA alignments, however here we take 2-182 as many 1st positions are missing), "B_pocket" - residues 7, 9, 24, 25, 34, 45, 63, 66, 67, 70, 99 and "F_pocket" - residues 77, 80, 81, 84, 95, 116, 123, 143, 146, 147. Then all the alleles containing gaps, stop codons or indels are discarded. Finally distance is calculated for each pair.

See Robinson J. 2017. for more details on the choice of exons 2 and 3.

Examples

hlaCallsGranthamDistance(MiDAS_tut_HLA, genes = "A")
#>        ID          A
#> 1    C001  3.8121547
#> 2    C002  0.8729282
#> 3    C003  3.5580110
#> 4    C004 10.6077348
#> 5    C005  9.1712707
#> 6    C006  5.7458564
#> 7    C007 10.5027624
#> 8    C008  8.1049724
#> 9    C009 11.3867403
#> 10   C010  7.4585635
#> 11   C011 10.5027624
#> 12   C012  0.0000000
#> 13   C013 10.7237569
#> 14   C014  8.8563536
#> 15   C015  6.4254144
#> 16   C016  7.0718232
#> 17   C017  3.0828729
#> 18   C018  8.1049724
#> 19   C019  6.5635359
#> 20   C020  6.6408840
#> 21   C021  8.1049724
#> 22   C022  9.1712707
#> 23   C023  9.9116022
#> 24   C024  9.9226519
#> 25   C025  4.9668508
#> 26   C026 10.7900552
#> 27   C027  0.0000000
#> 28   C028 10.5027624
#> 29   C029  0.0000000
#> 30   C030  4.4585635
#> 31   C031  7.0718232
#> 32   C032 10.6574586
#> 33   C033 10.5027624
#> 34   C034  5.2044199
#> 35   C035 10.5027624
#> 36   C036 10.5966851
#> 37   C037  0.0000000
#> 38   C038 10.9447514
#> 39   C039  8.9447514
#> 40   C040  6.1270718
#> 41   C041  6.3204420
#> 42   C042  6.4254144
#> 43   C043 10.5027624
#> 44   C044 13.0441989
#> 45   C045  7.6022099
#> 46   C046  9.1712707
#> 47   C047  3.0828729
#> 48   C048  7.0386740
#> 49   C049 10.3425414
#> 50   C050  3.0828729
#> 51   C051  9.1215470
#> 52   C052 12.4861878
#> 53   C053  0.0000000
#> 54   C054  5.7458564
#> 55   C055 10.6077348
#> 56   C056  0.0000000
#> 57   C057  2.2209945
#> 58   C058 10.6629834
#> 59   C059 10.9447514
#> 60   C060 10.5027624
#> 61   C061  6.4254144
#> 62   C062  9.9116022
#> 63   C063  8.9447514
#> 64   C064  0.0000000
#> 65   C065  0.0000000
#> 66   C066 10.2928177
#> 67   C067  8.9723757
#> 68   C068  8.1878453
#> 69   C069  9.1712707
#> 70   C070 10.8232044
#> 71   C071  0.0000000
#> 72   C072 10.6077348
#> 73   C073  4.3204420
#> 74   C074 10.2928177
#> 75   C075  5.1215470
#> 76   C076  7.4198895
#> 77   C077  8.9171271
#> 78   C078  5.3591160
#> 79   C079  0.0000000
#> 80   C080  8.9447514
#> 81   C081  6.4254144
#> 82   C082  2.8176796
#> 83   C083  0.0000000
#> 84   C084  8.5911602
#> 85   C085  8.5801105
#> 86   C086  8.9723757
#> 87   C087  6.4254144
#> 88   C088 10.6574586
#> 89   C089  4.1823204
#> 90   C090  0.0000000
#> 91   C091 10.5027624
#> 92   C092 10.4861878
#> 93   C093 12.1325967
#> 94   C094 12.9502762
#> 95   C095  1.4861878
#> 96   C096  7.4198895
#> 97   C097  5.2044199
#> 98   C098 10.2928177
#> 99   C099 13.6961326
#> 100  C100  3.0718232
#> 101  C101 10.4861878
#> 102  C102 10.5027624
#> 103  C103  0.0000000
#> 104  C104  8.9723757
#> 105  C105  6.4254144
#> 106  C106  7.0883978
#> 107  C107  4.8232044
#> 108  C108  7.4198895
#> 109  C109 12.8674033
#> 110  C110  5.3038674
#> 111  C111 10.6574586
#> 112  C112 10.5027624
#> 113  C113  7.4585635
#> 114  C114  9.1712707
#> 115  C115  7.4475138
#> 116  C116  0.0000000
#> 117  C117  0.0000000
#> 118  C118  0.0000000
#> 119  C119  0.1215470
#> 120  C120  4.1823204
#> 121  C121 10.5966851
#> 122  C122  3.0828729
#> 123  C123  0.8729282
#> 124  C124 13.0441989
#> 125  C125  4.7569061
#> 126  C126  3.0828729
#> 127  C127 10.9447514
#> 128  C128  6.2983425
#> 129  C129  5.0441989
#> 130  C130  3.2044199
#> 131  C131  6.3204420
#> 132  C132  5.7458564
#> 133  C133  6.4254144
#> 134  C134 10.5027624
#> 135  C135 10.6961326
#> 136  C136 10.2486188
#> 137  C137  3.7790055
#> 138  C138  8.9723757
#> 139  C139  2.3259669
#> 140  C140  7.2928177
#> 141  C141 10.5027624
#> 142  C142 10.6629834
#> 143  C143  6.4254144
#> 144  C144  3.0718232
#> 145  C145 11.6685083
#> 146  C146  7.0386740
#> 147  C147 10.5027624
#> 148  C148 10.5027624
#> 149  C149  9.4033149
#> 150  C150  8.3038674
#> 151  C151  0.0000000
#> 152  C152  3.2044199
#> 153  C153  4.2651934
#> 154  C154 10.2928177
#> 155  C155  0.8729282
#> 156  C156 10.6077348
#> 157  C157 10.8011050
#> 158  C158 10.2596685
#> 159  C159  8.1049724
#> 160  C160  7.0386740
#> 161  C161  7.8011050
#> 162  C162  5.2044199
#> 163  C163 10.2928177
#> 164  C164  6.4254144
#> 165  C165  0.0000000
#> 166  C166  6.4254144
#> 167  C167  0.0000000
#> 168  C168 10.6961326
#> 169  C169  0.0000000
#> 170  C170  8.2375691
#> 171  C171  9.5911602
#> 172  C172 10.2928177
#> 173  C173  0.0000000
#> 174  C174  7.5193370
#> 175  C175  7.6022099
#> 176  C176 10.1988950
#> 177  C177  0.0000000
#> 178  C178  5.7458564
#> 179  C179  0.0000000
#> 180  C180  0.0000000
#> 181  C181 10.2928177
#> 182  C182 10.9447514
#> 183  C183  9.7182320
#> 184  C184  9.0773481
#> 185  C185  6.4254144
#> 186  C186  8.9447514
#> 187  C187 13.0441989
#> 188  C188  0.0000000
#> 189  C189  2.7016575
#> 190  C190 12.9502762
#> 191  C191  3.5469613
#> 192  C192  0.0000000
#> 193  C193 10.4861878
#> 194  C194 10.4861878
#> 195  C195  5.4364641
#> 196  C196  6.6408840
#> 197  C197 10.5027624
#> 198  C198 13.0441989
#> 199  C199  5.7458564
#> 200  C200 11.3867403
#> 201  C201  6.4254144
#> 202  C202 10.4861878
#> 203  C203  7.6243094
#> 204  C204  8.8563536
#> 205  C205 10.5027624
#> 206  C206  5.9613260
#> 207  C207 10.5027624
#> 208  C208  8.1878453
#> 209  C209  3.2596685
#> 210  C210  5.0883978
#> 211  C211  7.4198895
#> 212  C212 10.7955801
#> 213  C213  0.0000000
#> 214  C214  6.0055249
#> 215  C215  9.1767956
#> 216  C216  6.6408840
#> 217  C217  6.4254144
#> 218  C218 10.6574586
#> 219  C219 10.9447514
#> 220  C220  8.1049724
#> 221  C221  3.2044199
#> 222  C222  5.7458564
#> 223  C223  8.1049724
#> 224  C224 12.4861878
#> 225  C225  0.0000000
#> 226  C226  5.7458564
#> 227  C227  6.2320442
#> 228  C228  3.5469613
#> 229  C229  4.6740331
#> 230  C230  0.0000000
#> 231  C231  9.7403315
#> 232  C232 10.6574586
#> 233  C233 10.5966851
#> 234  C234  0.0000000
#> 235  C235  9.0773481
#> 236  C236  7.4033149
#> 237  C237  0.0000000
#> 238  C238  9.9116022
#> 239  C239 10.7237569
#> 240  C240 13.0441989
#> 241  C241  6.4254144
#> 242  C242  6.2320442
#> 243  C243 10.3314917
#> 244  C244 12.4861878
#> 245  C245  5.1215470
#> 246  C246  0.0000000
#> 247  C247  8.1049724
#> 248  C248  7.0718232
#> 249  C249  5.4696133
#> 250  C250  0.0000000
#> 251  C251  3.7900552
#> 252  C252  0.0000000
#> 253  C253 10.6464088
#> 254  C254  2.3977901
#> 255  C255  8.2375691
#> 256  C256 11.3867403
#> 257  C257 10.2596685
#> 258  C258  6.2983425
#> 259  C259 10.6961326
#> 260  C260  6.9613260
#> 261  C261 10.6574586
#> 262  C262  0.0000000
#> 263  C263  7.0718232
#> 264  C264  6.5138122
#> 265  C265 11.0386740
#> 266  C266  8.9447514
#> 267  C267 10.2928177
#> 268  C268  7.4198895
#> 269  C269  4.2651934
#> 270  C270  5.3591160
#> 271  C271  3.0718232
#> 272  C272 10.9447514
#> 273  C273 10.9447514
#> 274  C274  4.8232044
#> 275  C275  6.3812155
#> 276  C276  6.3204420
#> 277  C277 10.2596685
#> 278  C278  3.2596685
#> 279  C279  6.3204420
#> 280  C280  8.1878453
#> 281  C281  8.1878453
#> 282  C282 10.2928177
#> 283  C283 10.5027624
#> 284  C284  9.7237569
#> 285  C285  9.1712707
#> 286  C286 10.5027624
#> 287  C287 10.5027624
#> 288  C288  6.4254144
#> 289  C289  8.9447514
#> 290  C290 10.5027624
#> 291  C291  0.0000000
#> 292  C292  1.2928177
#> 293  C293  0.0000000
#> 294  C294  8.1878453
#> 295  C295  6.4254144
#> 296  C296  8.9447514
#> 297  C297  5.7458564
#> 298  C298  8.9944751
#> 299  C299 10.7513812
#> 300  C300 13.0441989
#> 301  C301  5.1215470
#> 302  C302  6.4254144
#> 303  C303 10.6077348
#> 304  C304  5.2044199
#> 305  C305  6.4254144
#> 306  C306 10.9447514
#> 307  C307  8.1049724
#> 308  C308  0.0000000
#> 309  C309  8.2375691
#> 310  C310  3.0718232
#> 311  C311  8.9723757
#> 312  C312 12.1325967
#> 313  C313 10.6077348
#> 314  C314  1.0773481
#> 315  C315  3.5469613
#> 316  C316 10.6574586
#> 317  C317 10.9447514
#> 318  C318 10.5027624
#> 319  C319 13.0441989
#> 320  C320  7.9613260
#> 321  C321 10.6574586
#> 322  C322  5.7458564
#> 323  C323  8.2375691
#> 324  C324  7.6022099
#> 325  C325  3.0828729
#> 326  C326  0.3093923
#> 327  C327 10.5027624
#> 328  C328  8.3038674
#> 329  C329  6.6408840
#> 330  C330  5.3922652
#> 331  C331 10.6077348
#> 332  C332  3.7071823
#> 333  C333 10.5027624
#> 334  C334  6.1270718
#> 335  C335  3.7845304
#> 336  C336  8.9171271
#> 337  C337  6.4254144
#> 338  C338 10.5248619
#> 339  C339  5.5303867
#> 340  C340  5.3591160
#> 341  C341  4.1325967
#> 342  C342 10.9889503
#> 343  C343  9.2651934
#> 344  C344  8.9723757
#> 345  C345 10.7955801
#> 346  C346  5.7458564
#> 347  C347  7.9171271
#> 348  C348 10.5027624
#> 349  C349  5.4254144
#> 350  C350 10.4861878
#> 351  C351  5.4364641
#> 352  C352  7.4475138
#> 353  C353  6.6408840
#> 354  C354  6.6408840
#> 355  C355  9.9116022
#> 356  C356 10.5027624
#> 357  C357  3.2044199
#> 358  C358  8.5966851
#> 359  C359  6.4254144
#> 360  C360 10.5027624
#> 361  C361  3.2044199
#> 362  C362  9.3922652
#> 363  C363 10.4861878
#> 364  C364 10.4861878
#> 365  C365  4.9060773
#> 366  C366 10.6077348
#> 367  C367  8.9447514
#> 368  C368  3.1215470
#> 369  C369  5.2983425
#> 370  C370  7.2707182
#> 371  C371 12.9502762
#> 372  C372  5.2044199
#> 373  C373  7.4033149
#> 374  C374  3.7790055
#> 375  C375  8.9447514
#> 376  C376  6.2541436
#> 377  C377  0.0000000
#> 378  C378  8.9723757
#> 379  C379  8.9723757
#> 380  C380  9.1712707
#> 381  C381 10.6574586
#> 382  C382  5.3591160
#> 383  C383 10.6077348
#> 384  C384 10.6574586
#> 385  C385 10.5027624
#> 386  C386  6.4254144
#> 387  C387 10.6574586
#> 388  C388  6.4254144
#> 389  C389  8.1823204
#> 390  C390 10.2596685
#> 391  C391  6.4254144
#> 392  C392  3.2044199
#> 393  C393 11.3425414
#> 394  C394  8.9171271
#> 395  C395 12.4861878
#> 396  C396  6.2320442
#> 397  C397 10.6574586
#> 398  C398  7.5193370
#> 399  C399 10.6574586
#> 400  C400 10.6574586
#> 401  C401 10.6574586
#> 402  C402  9.4033149
#> 403  C403  0.0000000
#> 404  C404 10.9447514
#> 405  C405 10.6574586
#> 406  C406  0.0000000
#> 407  C407  0.0000000
#> 408  C408  7.0994475
#> 409  C409  4.8287293
#> 410  C410  8.1049724
#> 411  C411  7.5193370
#> 412  C412 10.1988950
#> 413  C413  4.8508287
#> 414  C414 13.0441989
#> 415  C415 10.6574586
#> 416  C416 10.6077348
#> 417  C417  5.3591160
#> 418  C418  3.7790055
#> 419  C419  9.0773481
#> 420  C420  3.7790055
#> 421  C421  6.9889503
#> 422  C422  3.2044199
#> 423  C423  4.0607735
#> 424  C424 10.2928177
#> 425  C425  6.2983425
#> 426  C426  1.9116022
#> 427  C427 10.4861878
#> 428  C428  0.0000000
#> 429  C429  2.7845304
#> 430  C430 10.9447514
#> 431  C431  6.4143646
#> 432  C432 11.6685083
#> 433  C433  6.4254144
#> 434  C434  9.7403315
#> 435  C435  3.0828729
#> 436  C436 11.3867403
#> 437  C437  0.0000000
#> 438  C438 13.0441989
#> 439  C439 10.6961326
#> 440  C440  4.6740331
#> 441  C441  5.2044199
#> 442  C442  0.0000000
#> 443  C443  6.4254144
#> 444  C444  6.4254144
#> 445  C445  8.1049724
#> 446  C446  8.9447514
#> 447  C447  8.9723757
#> 448  C448  5.9723757
#> 449  C449 10.3425414
#> 450  C450  1.4475138
#> 451  C451  6.4254144
#> 452  C452  8.1049724
#> 453  C453  0.0000000
#> 454  C454  6.4254144
#> 455  C455  4.1325967
#> 456  C456 10.6574586
#> 457  C457 10.5027624
#> 458  C458 10.5027624
#> 459  C459  5.2044199
#> 460  C460  8.1049724
#> 461  C461  8.5966851
#> 462  C462 10.5027624
#> 463  C463  0.7513812
#> 464  C464 10.6574586
#> 465  C465  8.9723757
#> 466  C466  0.0000000
#> 467  C467 10.6961326
#> 468  C468 10.5248619
#> 469  C469 10.5027624
#> 470  C470  7.5193370
#> 471  C471 12.4861878
#> 472  C472 10.6574586
#> 473  C473 10.5027624
#> 474  C474  8.2375691
#> 475  C475 10.6574586
#> 476  C476  3.0828729
#> 477  C477 10.5027624
#> 478  C478  0.0000000
#> 479  C479  8.9723757
#> 480  C480 10.6574586
#> 481  C481  0.8729282
#> 482  C482  0.0000000
#> 483  C483  9.7403315
#> 484  C484  6.4254144
#> 485  C485 10.2928177
#> 486  C486  6.4254144
#> 487  C487 10.5027624
#> 488  C488 10.6464088
#> 489  C489  2.8176796
#> 490  C490  3.0718232
#> 491  C491 10.5027624
#> 492  C492  3.2044199
#> 493  C493  0.0000000
#> 494  C494  8.9944751
#> 495  C495 10.6077348
#> 496  C496  0.0000000
#> 497  C497 10.2928177
#> 498  C498 11.2707182
#> 499  C499  9.2265193
#> 500  C500  6.3204420
#> 501  P001 10.9447514
#> 502  P002  0.0000000
#> 503  P003  8.1049724
#> 504  P004 10.6629834
#> 505  P005 10.6574586
#> 506  P006  5.7458564
#> 507  P007  6.4254144
#> 508  P008  0.0000000
#> 509  P009  7.0386740
#> 510  P010  3.0718232
#> 511  P011  8.0441989
#> 512  P012  0.0000000
#> 513  P013  0.0000000
#> 514  P014  7.5193370
#> 515  P015 10.6574586
#> 516  P016  8.9447514
#> 517  P017  4.4309392
#> 518  P018 10.6574586
#> 519  P019 10.6574586
#> 520  P020 10.6077348
#> 521  P021  8.1049724
#> 522  P022  8.9723757
#> 523  P023  1.2928177
#> 524  P024  3.0718232
#> 525  P025 10.3314917
#> 526  P026  8.1049724
#> 527  P027  5.7458564
#> 528  P028  2.1436464
#> 529  P029  0.0000000
#> 530  P030  7.6243094
#> 531  P031 10.6961326
#> 532  P032  7.0386740
#> 533  P033  8.5911602
#> 534  P034 10.9447514
#> 535  P035  6.4254144
#> 536  P036  6.4254144
#> 537  P037 10.6574586
#> 538  P038  0.0000000
#> 539  P039  6.4254144
#> 540  P040 10.1988950
#> 541  P041 10.6574586
#> 542  P042 10.6574586
#> 543  P043  0.0000000
#> 544  P044 10.6574586
#> 545  P045  6.5138122
#> 546  P046  7.6243094
#> 547  P047  4.6740331
#> 548  P048 10.5027624
#> 549  P049  7.8618785
#> 550  P050  4.6740331
#> 551  P051  6.4254144
#> 552  P052  0.0000000
#> 553  P053  6.1270718
#> 554  P054  8.9723757
#> 555  P055  3.2596685
#> 556  P056  5.0441989
#> 557  P057 10.6574586
#> 558  P058 12.4861878
#> 559  P059  8.9723757
#> 560  P060 10.5027624
#> 561  P061 10.6077348
#> 562  P062  8.1049724
#> 563  P063  3.7900552
#> 564  P064  0.0000000
#> 565  P065  0.0000000
#> 566  P066  5.8397790
#> 567  P067 10.5027624
#> 568  P068  8.9171271
#> 569  P069  6.3204420
#> 570  P070  0.0000000
#> 571  P071 10.6574586
#> 572  P072  0.0000000
#> 573  P073 10.9447514
#> 574  P074  6.5138122
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