| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CDK2 | CDK2_HUMAN | 2BTSA | P24941 | 1 | 298 | 298.0 | U32:1299 | Type1 | Inactive | DFGin | 8.571 | 15.954 | BLBminus | -131.25, 144.03 | 57.41, 68.71 | -62.53, 135.6 | 279.58, 62.82 | -80.98, 150.36 | out-out | out | 15.624 | Saltbr-out | 14.997 | HRD-in | -78.23, -53.97 | 79.57, -25.97 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 156.64 | APE8-dihe-in | -86.98, 135.56 | APE8-rot-in | 291.23 | APE67-dihe-in | -60.1, -28.56 | -107.23, -11.81 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.197 | None | None | None | XRAY | 1.99 | 0.216 | 0.261 | A | 298 | 274 | 24 | 0 | 0 | 15 | [[4, 286]] | 1.0 | 2bts | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | MAPK10 | MK10_HUMAN | 3PTGA | P53779 | 46 | 401 | 464.0 | 932:60001 | Type1 | Inactive | DFGin | 3.713 | 13.158 | None | -76.5, -95.65 | -85.65, -153.0 | -174.62, 83.6 | 38.12, 37.79 | -80.26, -75.99 | in-in | in | 8.949 | Saltbr-in | 2.713 | HRD-in | -82.38, -47.37 | 67.19, -16.55 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -33.68 | APE8-dihe-out | 167.39, -0.43 | APE8-rot-out | 180.66 | APE67-dihe-in | -48.92, -26.13 | -62.89, -39.18 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.804 | None | None | None | XRAY | 2.43 | 0.247 | 0.316 | A | 363 | 340 | 16 | 0 | 0 | 13 | [[64, 359]] | 1.0 | 3ptg | CMGC_MAPK10_HUMAN | CMGC | 1.4e-85 | 293.1 | 1 | 301 | 301 | 206 | 207 | 208 | 210 | 212 | 93 | 111 | 115 | 186 | 188 | 187 | 189 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 147 | Mitogen-activated protein kinase 10 |
| TKL | BRAF | BRAF_HUMAN | 4RZVA | P15056 | 449 | 721 | 766.0 | 032:801 | Type1.5_Back | Inactive | DFGin | 6.623 | 12.87 | BLAplus | -130.91, -172.9 | 60.6, 24.8 | -98.53, -10.69 | 57.76, 91.05 | -69.22, 172.66 | out-out | out | 12.644 | Saltbr-out | 10.258 | HRD-in | -67.58, -51.33 | 73.51, -5.96 | out-out-out | SNCooo | out-out | ActLoopNT-out | 7.109 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nioo | APE10-dihe-na | -135.17, 121.31 | APE9-dihe-na | -132.69, 47.25 | APE8-dihe-in | -116.19, 105.13 | APE8-rot-in | 306.78 | APE67-dihe-in | -65.92, -31.75 | -100.96, -1.47 | APE12-dist-none | 999.0 | APE11-dist-in | 13.566 | APE10-dist-out | 15.169 | APE9-dist-out | 10.302 | R509H,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E,P722S,K723G | None | None | XRAY | 2.994 | 0.207 | 0.267 | A | 281 | 261 | 12 | 0 | 0 | 12 | [[457, 716]] | 1.0 | 4rzv | TKL_BRAF_HUMAN | TKL | 7.2e-84 | 287.4 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | BRAF | BRAF_HUMAN | 4RZVB | P15056 | 449 | 722 | 766.0 | 032:801 | Type1.5_Back | Inactive | DFGin | 6.47 | 12.835 | BLAplus | -121.2, 178.65 | 56.71, 36.71 | -99.28, -19.01 | 59.27, 87.57 | -68.87, 172.54 | out-out | out | 12.328 | Saltbr-out | 11.67 | HRD-in | -71.84, -50.61 | 63.03, 10.44 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.743 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioo | APE10-dihe-na | -82.65, 28.28 | APE9-dihe-na | -100.48, -28.28 | APE8-dihe-in | -136.49, 95.01 | APE8-rot-in | 296.61 | APE67-dihe-in | -55.46, -18.41 | -85.27, -21.3 | APE12-dist-in | 13.178 | APE11-dist-in | 13.816 | APE10-dist-out | 18.847 | APE9-dist-out | 11.166 | R509H,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E,P722S,K723G | None | None | XRAY | 2.994 | 0.207 | 0.267 | B | 281 | 271 | 3 | 0 | 0 | 0 | [[457, 716]] | 1.0 | 4rzv | TKL_BRAF_HUMAN | TKL | 7.2e-84 | 287.4 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | BRAF | BRAF_HUMAN | 3OG7A | P15056 | 449 | 720 | 766.0 | 032:1 | Type1.5_Back | Inactive | DFGin | 5.36 | 13.446 | BLAplus | -137.59, -179.01 | 76.97, 18.21 | -89.25, -11.03 | 54.09, 93.51 | -42.45, 999.0 | out-out | out | 11.242 | Saltbr-out | 8.406 | HRD-in | -57.13, -46.63 | 78.91, -15.01 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -115.54 | APE8-dihe-in | -81.75, 114.02 | APE8-rot-out | 53.56 | APE67-dihe-in | -69.21, -23.46 | -108.29, -5.23 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.262 | K522A,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E | None | None | XRAY | 2.45 | 0.214 | 0.258 | A | 289 | 247 | 25 | 0 | 0 | 18 | [[457, 716]] | 1.0 | 3og7 | TKL_BRAF_HUMAN | TKL | 1.2e-83 | 286.6 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | MAP3K20 | M3K20_HUMAN | 5HESB | Q9NYL2 | 7 | 298 | 800.0 | 032:401 | Type1 | Inactive | DFGin | 6.41 | 13.023 | BLAplus | -143.58, 177.64 | 72.44, 21.16 | -87.16, -28.78 | 42.57, 80.13 | -79.68, 999.0 | out-out | out | 13.614 | Saltbr-out | 12.253 | HRD-in | -72.66, -57.27 | 76.35, 0.44 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -8.17 | APE8-dihe-out | -112.48, -1.68 | APE8-rot-in | 299.88 | APE67-dihe-in | -59.28, -26.85 | -56.83, -32.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 12.611 | None | TPO161 | TPO161 | XRAY | 2.14 | 0.18 | 0.226 | B | 307 | 278 | 14 | 0 | 0 | 14 | [[16, 262]] | 1.0 | 5hes | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.5 | 2 | 266 | 265 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 5HESA | Q9NYL2 | 6 | 299 | 800.0 | 032:401 | Type1.5_Back | Inactive | DFGin | 6.508 | 12.947 | BLAplus | -149.3, -178.78 | 72.05, 18.35 | -79.29, -13.47 | 42.54, 81.81 | -105.89, 8.43 | out-out | out | 10.327 | Saltbr-out | 7.91 | HRD-in | -63.65, -61.5 | 81.63, -14.81 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.531 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 65.01 | APE8-dihe-out | -130.74, 34.59 | APE8-rot-out | 64.32 | APE67-dihe-in | -59.25, -25.49 | -57.81, -30.45 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 12.632 | None | TPO161 | TPO161 | XRAY | 2.14 | 0.18 | 0.226 | A | 307 | 288 | 6 | 0 | 0 | 6 | [[16, 262]] | 1.0 | 5hes | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.5 | 2 | 266 | 265 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TYR | EGFR | EGFR_HUMAN | 3W32A | P00533 | 701 | 1017 | 1210.0 | W32:1101 | Type1.5_Back | Inactive | DFGin | 4.654 | 13.377 | BLBplus | -134.93, 174.75 | 75.62, 15.73 | -74.59, 136.0 | 48.33, 88.42 | 85.13, 3.49 | out-out | out | 14.094 | Saltbr-out | 13.598 | HRD-in | -69.8, -59.18 | 76.05, -4.36 | out-out-in | SNCooi | out-in | ActLoopNT-out | 6.242 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -118.7, 158.18 | APE9-dihe-in | -131.47, 158.06 | APE8-dihe-in | -79.68, 77.14 | APE8-rot-na | 27.77 | APE67-dihe-in | -73.57, -6.08 | -55.16, -38.17 | APE12-dist-na | 16.516 | APE11-dist-na | 12.808 | APE10-dist-na | 13.448 | APE9-dist-in | 7.197 | None | None | None | XRAY | 1.8 | 0.202 | 0.236 | A | 330 | 317 | 0 | 0 | 0 | 0 | [[712, 970]] | 1.0 | 3w32 | TYR_EGFR_HUMAN | TYR | 1.1e-87 | 299.7 | 3 | 259 | 257 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CDK2 | CDK2_HUMAN | 2BTSA | P24941 | 1 | 298 | 298.0 | U32:1299 | Type1 | Inactive | DFGin | 8.571 | 15.954 | BLBminus | -131.25, 144.03 | 57.41, 68.71 | -62.53, 135.6 | 279.58, 62.82 | -80.98, 150.36 | out-out | out | 15.624 | Saltbr-out | 14.997 | HRD-in | -78.23, -53.97 | 79.57, -25.97 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 156.64 | APE8-dihe-in | -86.98, 135.56 | APE8-rot-in | 291.23 | APE67-dihe-in | -60.1, -28.56 | -107.23, -11.81 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.197 | None | None | None | XRAY | 1.99 | 0.216 | 0.261 | A | 298 | 274 | 24 | 0 | 0 | 15 | [[4, 286]] | 1.0 | 2bts | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | MAPK10 | MK10_HUMAN | 3PTGA | P53779 | 46 | 401 | 464.0 | 932:60001 | Type1 | Inactive | DFGin | 3.713 | 13.158 | None | -76.5, -95.65 | -85.65, -153.0 | -174.62, 83.6 | 38.12, 37.79 | -80.26, -75.99 | in-in | in | 8.949 | Saltbr-in | 2.713 | HRD-in | -82.38, -47.37 | 67.19, -16.55 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -33.68 | APE8-dihe-out | 167.39, -0.43 | APE8-rot-out | 180.66 | APE67-dihe-in | -48.92, -26.13 | -62.89, -39.18 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.804 | None | None | None | XRAY | 2.43 | 0.247 | 0.316 | A | 363 | 340 | 16 | 0 | 0 | 13 | [[64, 359]] | 1.0 | 3ptg | Homo sapiens | CMGC_MAPK10_HUMAN | CMGC | 1.4e-85 | 293.1 | 1 | 301 | 301 | 206 | 207 | 208 | 210 | 212 | 93 | 111 | 115 | 186 | 188 | 187 | 189 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 147 | Mitogen-activated protein kinase 10 |
| TKL | BRAF | BRAF_HUMAN | 4RZVA | P15056 | 449 | 721 | 766.0 | 032:801 | Type1.5_Back | Inactive | DFGin | 6.623 | 12.87 | BLAplus | -130.91, -172.9 | 60.6, 24.8 | -98.53, -10.69 | 57.76, 91.05 | -69.22, 172.66 | out-out | out | 12.644 | Saltbr-out | 10.258 | HRD-in | -67.58, -51.33 | 73.51, -5.96 | out-out-out | SNCooo | out-out | ActLoopNT-out | 7.109 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nioo | APE10-dihe-na | -135.17, 121.31 | APE9-dihe-na | -132.69, 47.25 | APE8-dihe-in | -116.19, 105.13 | APE8-rot-in | 306.78 | APE67-dihe-in | -65.92, -31.75 | -100.96, -1.47 | APE12-dist-none | 999.0 | APE11-dist-in | 13.566 | APE10-dist-out | 15.169 | APE9-dist-out | 10.302 | R509H,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E,P722S,K723G | None | None | XRAY | 2.994 | 0.207 | 0.267 | A | 281 | 261 | 12 | 0 | 0 | 12 | [[457, 716]] | 1.0 | 4rzv | Homo sapiens | TKL_BRAF_HUMAN | TKL | 7.2e-84 | 287.4 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | BRAF | BRAF_HUMAN | 4RZVB | P15056 | 449 | 722 | 766.0 | 032:801 | Type1.5_Back | Inactive | DFGin | 6.47 | 12.835 | BLAplus | -121.2, 178.65 | 56.71, 36.71 | -99.28, -19.01 | 59.27, 87.57 | -68.87, 172.54 | out-out | out | 12.328 | Saltbr-out | 11.67 | HRD-in | -71.84, -50.61 | 63.03, 10.44 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.743 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioo | APE10-dihe-na | -82.65, 28.28 | APE9-dihe-na | -100.48, -28.28 | APE8-dihe-in | -136.49, 95.01 | APE8-rot-in | 296.61 | APE67-dihe-in | -55.46, -18.41 | -85.27, -21.3 | APE12-dist-in | 13.178 | APE11-dist-in | 13.816 | APE10-dist-out | 18.847 | APE9-dist-out | 11.166 | R509H,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E,P722S,K723G | None | None | XRAY | 2.994 | 0.207 | 0.267 | B | 281 | 271 | 3 | 0 | 0 | 0 | [[457, 716]] | 1.0 | 4rzv | Homo sapiens | TKL_BRAF_HUMAN | TKL | 7.2e-84 | 287.4 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | BRAF | BRAF_HUMAN | 3OG7A | P15056 | 449 | 720 | 766.0 | 032:1 | Type1.5_Back | Inactive | DFGin | 5.36 | 13.446 | BLAplus | -137.59, -179.01 | 76.97, 18.21 | -89.25, -11.03 | 54.09, 93.51 | -42.45, 999.0 | out-out | out | 11.242 | Saltbr-out | 8.406 | HRD-in | -57.13, -46.63 | 78.91, -15.01 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -115.54 | APE8-dihe-in | -81.75, 114.02 | APE8-rot-out | 53.56 | APE67-dihe-in | -69.21, -23.46 | -108.29, -5.23 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.262 | K522A,I543A,I544S,I551K,Q562R,L588N,K630S,F667E,Y673S,A688R,L706S,Q709R,S713E,L716E,S720E | None | None | XRAY | 2.45 | 0.214 | 0.258 | A | 289 | 247 | 25 | 0 | 0 | 18 | [[457, 716]] | 1.0 | 3og7 | Homo sapiens | TKL_BRAF_HUMAN | TKL | 1.2e-83 | 286.6 | 4 | 267 | 264 | 593 | 594 | 595 | 597 | 599 | 483 | 501 | 505 | 573 | 575 | 574 | 576 | 638 | 623 | 618 | 617 | 616 | 615 | 614 | 613 | 612 | 530 | Serine/threonine-protein kinase B-raf |
| TKL | MAP3K20 | M3K20_HUMAN | 5HESB | Q9NYL2 | 7 | 298 | 800.0 | 032:401 | Type1 | Inactive | DFGin | 6.41 | 13.023 | BLAplus | -143.58, 177.64 | 72.44, 21.16 | -87.16, -28.78 | 42.57, 80.13 | -79.68, 999.0 | out-out | out | 13.614 | Saltbr-out | 12.253 | HRD-in | -72.66, -57.27 | 76.35, 0.44 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -8.17 | APE8-dihe-out | -112.48, -1.68 | APE8-rot-in | 299.88 | APE67-dihe-in | -59.28, -26.85 | -56.83, -32.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 12.611 | None | TPO161 | TPO161 | XRAY | 2.14 | 0.18 | 0.226 | B | 307 | 278 | 14 | 0 | 0 | 14 | [[16, 262]] | 1.0 | 5hes | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.5 | 2 | 266 | 265 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 5HESA | Q9NYL2 | 6 | 299 | 800.0 | 032:401 | Type1.5_Back | Inactive | DFGin | 6.508 | 12.947 | BLAplus | -149.3, -178.78 | 72.05, 18.35 | -79.29, -13.47 | 42.54, 81.81 | -105.89, 8.43 | out-out | out | 10.327 | Saltbr-out | 7.91 | HRD-in | -63.65, -61.5 | 81.63, -14.81 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.531 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 65.01 | APE8-dihe-out | -130.74, 34.59 | APE8-rot-out | 64.32 | APE67-dihe-in | -59.25, -25.49 | -57.81, -30.45 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 12.632 | None | TPO161 | TPO161 | XRAY | 2.14 | 0.18 | 0.226 | A | 307 | 288 | 6 | 0 | 0 | 6 | [[16, 262]] | 1.0 | 5hes | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.5 | 2 | 266 | 265 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TYR | EGFR | EGFR_HUMAN | 3W32A | P00533 | 701 | 1017 | 1210.0 | W32:1101 | Type1.5_Back | Inactive | DFGin | 4.654 | 13.377 | BLBplus | -134.93, 174.75 | 75.62, 15.73 | -74.59, 136.0 | 48.33, 88.42 | 85.13, 3.49 | out-out | out | 14.094 | Saltbr-out | 13.598 | HRD-in | -69.8, -59.18 | 76.05, -4.36 | out-out-in | SNCooi | out-in | ActLoopNT-out | 6.242 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -118.7, 158.18 | APE9-dihe-in | -131.47, 158.06 | APE8-dihe-in | -79.68, 77.14 | APE8-rot-na | 27.77 | APE67-dihe-in | -73.57, -6.08 | -55.16, -38.17 | APE12-dist-na | 16.516 | APE11-dist-na | 12.808 | APE10-dist-na | 13.448 | APE9-dist-in | 7.197 | None | None | None | XRAY | 1.8 | 0.202 | 0.236 | A | 330 | 317 | 0 | 0 | 0 | 0 | [[712, 970]] | 1.0 | 3w32 | Homo sapiens | TYR_EGFR_HUMAN | TYR | 1.1e-87 | 299.7 | 3 | 259 | 257 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| CMGC | ACK2 | CSK2A_MAIZE | 2OXDA | P28523 | 2 | 326 | 332.0 | K32:60338 | Type1 | Active | DFGin | 7.627 | 16.533 | BLAminus | -113.97, -177.91 | 58.49, 67.22 | -84.76, 29.07 | 300.12, 84.53 | -72.16, -27.75 | in-in | in | 9.841 | Saltbr-in | 2.913 | HRD-in | -66.78, -41.75 | 57.86, 18.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.783 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -120.26, -175.9 | APE9-dihe-na | 55.62, 178.78 | APE8-dihe-in | -103.46, 153.42 | APE8-rot-in | 304.07 | APE67-dihe-in | -72.09, -2.75 | -46.02, -54.8 | APE12-dist-in | 12.479 | APE11-dist-in | 10.395 | APE10-dist-in | 5.983 | APE9-dist-in | 2.906 | None | None | None | XRAY | 2.3 | 0.223 | 0.273 | A | 332 | 325 | 0 | 0 | 0 | 0 | [[34, 319]] | 1.0 | 2oxd | Zea mays | CMGC_ACK2_MAIZE | CMGC | 1.8e-65 | 227.0 | 1 | 301 | 301 | 169 | 170 | 171 | 173 | 175 | 63 | 76 | 80 | 148 | 150 | 149 | 151 | 209 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 109 | Casein kinase II subunit alpha |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | ACK2 | CSK2A_MAIZE | 2OXDA | P28523 | 2 | 326 | 332.0 | K32:60338 | Type1 | Active | DFGin | 7.627 | 16.533 | BLAminus | -113.97, -177.91 | 58.49, 67.22 | -84.76, 29.07 | 300.12, 84.53 | -72.16, -27.75 | in-in | in | 9.841 | Saltbr-in | 2.913 | HRD-in | -66.78, -41.75 | 57.86, 18.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.783 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -120.26, -175.9 | APE9-dihe-na | 55.62, 178.78 | APE8-dihe-in | -103.46, 153.42 | APE8-rot-in | 304.07 | APE67-dihe-in | -72.09, -2.75 | -46.02, -54.8 | APE12-dist-in | 12.479 | APE11-dist-in | 10.395 | APE10-dist-in | 5.983 | APE9-dist-in | 2.906 | None | None | None | XRAY | 2.3 | 0.223 | 0.273 | A | 332 | 325 | 0 | 0 | 0 | 0 | [[34, 319]] | 1.0 | 2oxd | Zea mays | CMGC_ACK2_MAIZE | CMGC | 1.8e-65 | 227.0 | 1 | 301 | 301 | 169 | 170 | 171 | 173 | 175 | 63 | 76 | 80 | 148 | 150 | 149 | 151 | 209 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 109 | Casein kinase II subunit alpha |