| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | IRAK4 | IRAK4_HUMAN | 7QG1A | Q9NWZ3 | 165 | 458 | 460.0 | B8I:501 | Type1 | Inactive | DFGin | 7.02 | 14.3894 | BLAminus | -118.81, -178.64 | 55.1, 76.86 | -97.97, 21.19 | 305.6, 72.54 | -63.87, -32.47 | in-out | in | 8.4699 | Saltbr-out | 5.3619 | HRD-in | -68.86, -48.74 | 75.05, -2.97 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8001 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.97, 148.67 | APE9-dihe-na | 139.86, -177.08 | APE8-dihe-in | -100.51, 118.37 | APE8-rot-in | 305.34 | APE67-dihe-in | -60.75, -17.99 | -59.84, -38.95 | APE12-dist-in | 10.0839 | APE11-dist-in | 11.8182 | APE10-dist-in | 6.3351 | APE9-dist-in | 4.0571 | None | TPO345,SEP346 | TPO345,SEP346 | XRAY | 2.07 | 0.249 | 0.285 | A | 322.0 | 266.0 | 28 | 30 | 23 | 7 | [[183, 456]] | 1.0 | 7qg1 | TKL_IRAK4_HUMAN | TKL | 5.2e-84 | 287.9 | 5.0 | 266.0 | 262.0 | 328 | 329 | 330 | 332 | 334 | 213 | 233 | 237 | 308 | 310 | 309 | 311.0 | 369 | 358 | 353 | 352 | 351 | 350 | 349 | 348 | 347 | 263 | Interleukin-1 receptor-associated kinase 4 |
| TKL | IRAK4 | IRAK4_HUMAN | 7QG1B | Q9NWZ3 | 164 | 458 | 460.0 | B8I:501 | Type1 | Inactive | DFGin | 7.2031 | 14.7406 | BLAminus | -127.97, 179.77 | 66.68, 77.1 | -104.37, 20.94 | 303.7, 91.21 | -70.61, -31.96 | in-out | in | 8.7539 | Saltbr-out | 4.3527 | HRD-in | -69.99, -48.76 | 75.97, -2.57 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.773 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.49, 147.07 | APE9-dihe-na | 141.42, -176.13 | APE8-dihe-in | -101.1, 117.88 | APE8-rot-in | 306.31 | APE67-dihe-in | -60.31, -17.27 | -61.18, -38.28 | APE12-dist-in | 10.0926 | APE11-dist-in | 11.7254 | APE10-dist-in | 6.2972 | APE9-dist-in | 4.1112 | None | TPO345,SEP346 | TPO345,SEP346 | XRAY | 2.07 | 0.249 | 0.285 | B | 322.0 | 282.0 | 13 | 30 | 23 | 7 | [[183, 456]] | 1.0 | 7qg1 | TKL_IRAK4_HUMAN | TKL | 5.2e-84 | 287.9 | 5.0 | 266.0 | 262.0 | 328 | 329 | 330 | 332 | 334 | 213 | 233 | 237 | 308 | 310 | 309 | 311.0 | 369 | 358 | 353 | 352 | 351 | 350 | 349 | 348 | 347 | 263 | Interleukin-1 receptor-associated kinase 4 |
| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | IRAK4 | IRAK4_HUMAN | 7QG1A | Q9NWZ3 | 165 | 458 | 460.0 | B8I:501 | Type1 | Inactive | DFGin | 7.02 | 14.3894 | BLAminus | -118.81, -178.64 | 55.1, 76.86 | -97.97, 21.19 | 305.6, 72.54 | -63.87, -32.47 | in-out | in | 8.4699 | Saltbr-out | 5.3619 | HRD-in | -68.86, -48.74 | 75.05, -2.97 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8001 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.97, 148.67 | APE9-dihe-na | 139.86, -177.08 | APE8-dihe-in | -100.51, 118.37 | APE8-rot-in | 305.34 | APE67-dihe-in | -60.75, -17.99 | -59.84, -38.95 | APE12-dist-in | 10.0839 | APE11-dist-in | 11.8182 | APE10-dist-in | 6.3351 | APE9-dist-in | 4.0571 | None | TPO345,SEP346 | TPO345,SEP346 | XRAY | 2.07 | 0.249 | 0.285 | A | 322.0 | 266.0 | 28 | 30 | 23 | 7 | [[183, 456]] | 1.0 | 7qg1 | Homo sapiens | TKL_IRAK4_HUMAN | TKL | 5.2e-84 | 287.9 | 5.0 | 266.0 | 262.0 | 328 | 329 | 330 | 332 | 334 | 213 | 233 | 237 | 308 | 310 | 309 | 311.0 | 369 | 358 | 353 | 352 | 351 | 350 | 349 | 348 | 347 | 263 | Interleukin-1 receptor-associated kinase 4 |
| TKL | IRAK4 | IRAK4_HUMAN | 7QG1B | Q9NWZ3 | 164 | 458 | 460.0 | B8I:501 | Type1 | Inactive | DFGin | 7.2031 | 14.7406 | BLAminus | -127.97, 179.77 | 66.68, 77.1 | -104.37, 20.94 | 303.7, 91.21 | -70.61, -31.96 | in-out | in | 8.7539 | Saltbr-out | 4.3527 | HRD-in | -69.99, -48.76 | 75.97, -2.57 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.773 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.49, 147.07 | APE9-dihe-na | 141.42, -176.13 | APE8-dihe-in | -101.1, 117.88 | APE8-rot-in | 306.31 | APE67-dihe-in | -60.31, -17.27 | -61.18, -38.28 | APE12-dist-in | 10.0926 | APE11-dist-in | 11.7254 | APE10-dist-in | 6.2972 | APE9-dist-in | 4.1112 | None | TPO345,SEP346 | TPO345,SEP346 | XRAY | 2.07 | 0.249 | 0.285 | B | 322.0 | 282.0 | 13 | 30 | 23 | 7 | [[183, 456]] | 1.0 | 7qg1 | Homo sapiens | TKL_IRAK4_HUMAN | TKL | 5.2e-84 | 287.9 | 5.0 | 266.0 | 262.0 | 328 | 329 | 330 | 332 | 334 | 213 | 233 | 237 | 308 | 310 | 309 | 311.0 | 369 | 358 | 353 | 352 | 351 | 350 | 349 | 348 | 347 | 263 | Interleukin-1 receptor-associated kinase 4 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|