| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | ALK | ALK_HUMAN | 4ANSA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2485 | 15.1618 | ABAminus | -128.23, -41.44 | -98.11, 120.9 | -117.53, 30.59 | 287.81, 85.26 | -66.49, -38.26 | in-out | in | 8.265 | Saltbr-out | 4.8918 | HRD-in | -72.85, -44.3 | 78.64, -9.03 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.908 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -99.15, -7.92 | APE9-dihe-in | -66.26, 134.84 | APE8-dihe-in | -77.14, 60.8 | APE8-rot-na | 30.33 | APE67-dihe-in | -70.27, -10.51 | -58.92, -29.59 | APE12-dist-na | 14.6611 | APE11-dist-na | 14.8834 | APE10-dist-na | 9.857 | APE9-dist-out | 8.0387 | L1196M,G1269A | None | None | XRAY | 1.85 | 0.201 | 0.231 | A | 342.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 4ans | TYR_ALK_HUMAN | TYR | 5.2e-91 | 310.5 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 2YFXA | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2206 | 14.8808 | ABAminus | -122.22, -28.6 | -114.9, 132.72 | -127.11, 33.52 | 293.03, 85.04 | -65.89, -37.73 | in-out | in | 7.9144 | Saltbr-out | 4.7498 | HRD-in | -73.95, -43.63 | 78.32, -9.23 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9557 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -100.12, -9.34 | APE9-dihe-in | -61.51, 137.47 | APE8-dihe-in | -77.72, 57.54 | APE8-rot-na | 29.78 | APE67-dihe-in | -70.24, -8.94 | -56.4, -32.44 | APE12-dist-na | 14.505 | APE11-dist-na | 14.9332 | APE10-dist-na | 9.9197 | APE9-dist-out | 8.0505 | L1196M | None | None | XRAY | 1.7 | 0.208 | 0.234 | A | 327.0 | 293.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 2yfx | TYR_ALK_HUMAN | TYR | 5.1e-91 | 310.5 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 4ANQA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2087 | 14.9738 | ABAminus | -128.3, -36.39 | -101.79, 127.42 | -123.56, 31.99 | 288.31, 85.14 | -69.12, -35.87 | in-out | in | 8.2697 | Saltbr-out | 4.7889 | HRD-in | -73.02, -46.15 | 80.91, -7.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.947 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -98.41, -8.07 | APE9-dihe-in | -67.75, 134.94 | APE8-dihe-in | -74.89, 59.28 | APE8-rot-na | 29.64 | APE67-dihe-in | -70.46, -10.96 | -58.56, -29.68 | APE12-dist-na | 14.7237 | APE11-dist-na | 14.9551 | APE10-dist-na | 9.9221 | APE9-dist-out | 8.0186 | G1269A | None | None | XRAY | 1.76 | 0.201 | 0.217 | A | 342.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 4anq | TYR_ALK_HUMAN | TYR | 1.4e-90 | 309.1 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AAAA | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2088 | 14.916 | ABAminus | -119.08, -27.29 | -116.14, 136.82 | -130.64, 32.52 | 289.46, 85.69 | -67.72, -37.15 | in-out | in | 7.9686 | Saltbr-out | 4.6697 | HRD-in | -74.4, -45.03 | 79.43, -9.27 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.8981 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -99.98, -3.96 | APE9-dihe-in | -73.12, 136.6 | APE8-dihe-in | -77.4, 61.62 | APE8-rot-na | 28.9 | APE67-dihe-in | -71.26, -10.51 | -60.21, -28.6 | APE12-dist-na | 14.5554 | APE11-dist-na | 14.8493 | APE10-dist-na | 9.8001 | APE9-dist-out | 8.0299 | L1198F | None | None | XRAY | 1.73 | 0.201 | 0.206 | A | 327.0 | 295.0 | 14 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aaa | TYR_ALK_HUMAN | TYR | 4.4e-91 | 310.7 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AABA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 5.962 | 14.9414 | ABAminus | -122.06, -28.4 | -115.22, 132.25 | -127.31, 26.85 | 289.37, 81.1 | -65.12, -33.9 | in-out | in | 8.0829 | Saltbr-out | 4.2699 | HRD-in | -73.35, -48.11 | 83.65, -8.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9633 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -103.88, -2.64 | APE9-dihe-in | -78.59, 133.38 | APE8-dihe-in | -74.05, 62.22 | APE8-rot-na | 30.08 | APE67-dihe-in | -71.71, -12.93 | -64.03, -23.79 | APE12-dist-na | 15.1004 | APE11-dist-na | 15.2049 | APE10-dist-na | 10.0874 | APE9-dist-out | 8.0863 | C1156Y,L1198F | None | None | XRAY | 2.2 | 0.211 | 0.246 | A | 327.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aab | TYR_ALK_HUMAN | TYR | 5.9e-91 | 310.3 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 2XP2A | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.01 | 14.8527 | ABAminus | -116.89, -30.31 | -113.6, 135.35 | -129.42, 33.32 | 290.86, 85.52 | -68.93, -36.66 | in-out | in | 8.312 | Saltbr-out | 4.8435 | HRD-in | -70.6, -46.14 | 82.26, -7.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.7853 | ActLoopCT-out | TYR | APEdihe_niiai | APEdist_aaao | APE10-dihe-none | 999.0, -14.78 | APE9-dihe-in | -71.8, 131.97 | APE8-dihe-in | -75.49, 62.54 | APE8-rot-na | 30.87 | APE67-dihe-in | -72.66, -13.49 | -62.38, -23.13 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 10.1483 | APE9-dist-out | 8.2573 | None | None | None | XRAY | 1.9 | 0.207 | 0.252 | A | 327.0 | 289.0 | 20 | 30 | 21 | 9 | [[1116, 1385]] | 1.0 | 2xp2 | TYR_ALK_HUMAN | TYR | 1.4e-90 | 309.1 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AACA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.0491 | 14.9478 | ABAminus | -115.19, -31.77 | -111.83, 134.22 | -128.43, 30.25 | 290.07, 81.16 | -65.53, -32.88 | in-out | in | 8.2704 | Saltbr-out | 4.6082 | HRD-in | -73.86, -46.4 | 82.42, -9.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9248 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -100.47, -8.93 | APE9-dihe-in | -64.75, 135.46 | APE8-dihe-in | -76.69, 59.35 | APE8-rot-na | 30.37 | APE67-dihe-in | -71.48, -11.11 | -59.44, -28.8 | APE12-dist-na | 14.7445 | APE11-dist-na | 15.3235 | APE10-dist-na | 10.293 | APE9-dist-out | 8.1919 | C1156Y | None | None | XRAY | 1.7 | 0.208 | 0.232 | A | 327.0 | 293.0 | 17 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aac | TYR_ALK_HUMAN | TYR | 1.9e-90 | 308.6 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | MET | MET_HUMAN | 2WGJA | P08581 | 1052 | 1345 | 1390.0 | VGH:2346 | Type1 | Inactive | DFGin | 5.4186 | 14.21 | BLBplus | -135.65, -156.26 | 47.26, 45.25 | -135.61, 161.65 | 71.89, 90.85 | 65.05, -128.27 | out-out | out | 14.4314 | Saltbr-out | 12.3445 | HRD-in | -73.92, -55.59 | 85.56, -13.18 | out-out-in | SNCooi | out-in | ActLoopNT-out | 10.8902 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -55.61, 121.54 | APE9-dihe-in | -139.09, 151.01 | APE8-dihe-in | -79.04, 70.35 | APE8-rot-na | 28.98 | APE67-dihe-in | -76.22, -0.44 | -56.63, -35.75 | APE12-dist-na | 22.7041 | APE11-dist-na | 17.972 | APE10-dist-na | 17.3403 | APE9-dist-in | 7.1491 | None | None | None | XRAY | 2.0 | 0.215 | 0.232 | A | 306.0 | 290.0 | 4 | 32 | 32 | 0 | [[1078, 1339]] | 1.0 | 2wgj | TYR_MET_HUMAN | TYR | 6.7e-92 | 313.6 | 2.0 | 260.0 | 259.0 | 1221 | 1222 | 1223 | 1225 | 1227 | 1110 | 1127 | 1131 | 1201 | 1203 | 1202 | 1204.0 | 1265 | 1253 | 1248 | 1247 | 1246 | 1245 | 1244 | 1243 | 1242 | 1158 | Hepatocyte growth factor receptor |
| TYR | ROS1 | ROS1_HUMAN | 3ZBFA | P08922 | 1934 | 2230 | 2347.0 | VGH:3000 | Type1 | Inactive | DFGin | 6.5532 | 14.5602 | ABAminus | -129.17, -37.91 | -114.96, 123.49 | -118.51, 31.51 | 297.44, 69.18 | -62.83, -16.28 | in-in | in | 8.5059 | Saltbr-in | 3.4994 | HRD-in | -86.85, -45.31 | 73.51, 7.34 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9375 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -30.1 | APE8-dihe-in | -94.83, 74.5 | APE8-rot-na | 33.93 | APE67-dihe-in | -65.41, -17.17 | -63.88, -31.54 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 10.0999 | None | None | None | XRAY | 2.2 | 0.236 | 0.282 | A | 322.0 | 282.0 | 15 | 30 | 18 | 12 | [[1945, 2217]] | 1.0 | 3zbf | TYR_ROS1_HUMAN | TYR | 5.4e-95 | 323.5 | 3.0 | 260.0 | 258.0 | 2101 | 2102 | 2103 | 2105 | 2107 | 1980 | 1997 | 2001 | 2076 | 2078 | 2077 | 2079.0 | 2143 | 2131 | 2126 | 2125 | 2124 | 2123 | 2122 | 2121 | 2120 | 2027 | Proto-oncogene tyrosine-protein kinase ROS |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | ALK | ALK_HUMAN | 4ANSA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2485 | 15.1618 | ABAminus | -128.23, -41.44 | -98.11, 120.9 | -117.53, 30.59 | 287.81, 85.26 | -66.49, -38.26 | in-out | in | 8.265 | Saltbr-out | 4.8918 | HRD-in | -72.85, -44.3 | 78.64, -9.03 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.908 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -99.15, -7.92 | APE9-dihe-in | -66.26, 134.84 | APE8-dihe-in | -77.14, 60.8 | APE8-rot-na | 30.33 | APE67-dihe-in | -70.27, -10.51 | -58.92, -29.59 | APE12-dist-na | 14.6611 | APE11-dist-na | 14.8834 | APE10-dist-na | 9.857 | APE9-dist-out | 8.0387 | L1196M,G1269A | None | None | XRAY | 1.85 | 0.201 | 0.231 | A | 342.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 4ans | Homo sapiens | TYR_ALK_HUMAN | TYR | 5.2e-91 | 310.5 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 2YFXA | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2206 | 14.8808 | ABAminus | -122.22, -28.6 | -114.9, 132.72 | -127.11, 33.52 | 293.03, 85.04 | -65.89, -37.73 | in-out | in | 7.9144 | Saltbr-out | 4.7498 | HRD-in | -73.95, -43.63 | 78.32, -9.23 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9557 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -100.12, -9.34 | APE9-dihe-in | -61.51, 137.47 | APE8-dihe-in | -77.72, 57.54 | APE8-rot-na | 29.78 | APE67-dihe-in | -70.24, -8.94 | -56.4, -32.44 | APE12-dist-na | 14.505 | APE11-dist-na | 14.9332 | APE10-dist-na | 9.9197 | APE9-dist-out | 8.0505 | L1196M | None | None | XRAY | 1.7 | 0.208 | 0.234 | A | 327.0 | 293.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 2yfx | Homo sapiens | TYR_ALK_HUMAN | TYR | 5.1e-91 | 310.5 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 4ANQA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2087 | 14.9738 | ABAminus | -128.3, -36.39 | -101.79, 127.42 | -123.56, 31.99 | 288.31, 85.14 | -69.12, -35.87 | in-out | in | 8.2697 | Saltbr-out | 4.7889 | HRD-in | -73.02, -46.15 | 80.91, -7.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.947 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -98.41, -8.07 | APE9-dihe-in | -67.75, 134.94 | APE8-dihe-in | -74.89, 59.28 | APE8-rot-na | 29.64 | APE67-dihe-in | -70.46, -10.96 | -58.56, -29.68 | APE12-dist-na | 14.7237 | APE11-dist-na | 14.9551 | APE10-dist-na | 9.9221 | APE9-dist-out | 8.0186 | G1269A | None | None | XRAY | 1.76 | 0.201 | 0.217 | A | 342.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 4anq | Homo sapiens | TYR_ALK_HUMAN | TYR | 1.4e-90 | 309.1 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AAAA | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.2088 | 14.916 | ABAminus | -119.08, -27.29 | -116.14, 136.82 | -130.64, 32.52 | 289.46, 85.69 | -67.72, -37.15 | in-out | in | 7.9686 | Saltbr-out | 4.6697 | HRD-in | -74.4, -45.03 | 79.43, -9.27 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.8981 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -99.98, -3.96 | APE9-dihe-in | -73.12, 136.6 | APE8-dihe-in | -77.4, 61.62 | APE8-rot-na | 28.9 | APE67-dihe-in | -71.26, -10.51 | -60.21, -28.6 | APE12-dist-na | 14.5554 | APE11-dist-na | 14.8493 | APE10-dist-na | 9.8001 | APE9-dist-out | 8.0299 | L1198F | None | None | XRAY | 1.73 | 0.201 | 0.206 | A | 327.0 | 295.0 | 14 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aaa | Homo sapiens | TYR_ALK_HUMAN | TYR | 4.4e-91 | 310.7 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AABA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 5.962 | 14.9414 | ABAminus | -122.06, -28.4 | -115.22, 132.25 | -127.31, 26.85 | 289.37, 81.1 | -65.12, -33.9 | in-out | in | 8.0829 | Saltbr-out | 4.2699 | HRD-in | -73.35, -48.11 | 83.65, -8.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9633 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -103.88, -2.64 | APE9-dihe-in | -78.59, 133.38 | APE8-dihe-in | -74.05, 62.22 | APE8-rot-na | 30.08 | APE67-dihe-in | -71.71, -12.93 | -64.03, -23.79 | APE12-dist-na | 15.1004 | APE11-dist-na | 15.2049 | APE10-dist-na | 10.0874 | APE9-dist-out | 8.0863 | C1156Y,L1198F | None | None | XRAY | 2.2 | 0.211 | 0.246 | A | 327.0 | 294.0 | 16 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aab | Homo sapiens | TYR_ALK_HUMAN | TYR | 5.9e-91 | 310.3 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 2XP2A | Q9UM73 | 1093 | 1401 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.01 | 14.8527 | ABAminus | -116.89, -30.31 | -113.6, 135.35 | -129.42, 33.32 | 290.86, 85.52 | -68.93, -36.66 | in-out | in | 8.312 | Saltbr-out | 4.8435 | HRD-in | -70.6, -46.14 | 82.26, -7.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.7853 | ActLoopCT-out | TYR | APEdihe_niiai | APEdist_aaao | APE10-dihe-none | 999.0, -14.78 | APE9-dihe-in | -71.8, 131.97 | APE8-dihe-in | -75.49, 62.54 | APE8-rot-na | 30.87 | APE67-dihe-in | -72.66, -13.49 | -62.38, -23.13 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 10.1483 | APE9-dist-out | 8.2573 | None | None | None | XRAY | 1.9 | 0.207 | 0.252 | A | 327.0 | 289.0 | 20 | 30 | 21 | 9 | [[1116, 1385]] | 1.0 | 2xp2 | Homo sapiens | TYR_ALK_HUMAN | TYR | 1.4e-90 | 309.1 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | ALK | ALK_HUMAN | 5AACA | Q9UM73 | 1093 | 1402 | 1620.0 | VGH:9000 | Type1 | Inactive | DFGin | 6.0491 | 14.9478 | ABAminus | -115.19, -31.77 | -111.83, 134.22 | -128.43, 30.25 | 290.07, 81.16 | -65.53, -32.88 | in-out | in | 8.2704 | Saltbr-out | 4.6082 | HRD-in | -73.86, -46.4 | 82.42, -9.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9248 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -100.47, -8.93 | APE9-dihe-in | -64.75, 135.46 | APE8-dihe-in | -76.69, 59.35 | APE8-rot-na | 30.37 | APE67-dihe-in | -71.48, -11.11 | -59.44, -28.8 | APE12-dist-na | 14.7445 | APE11-dist-na | 15.3235 | APE10-dist-na | 10.293 | APE9-dist-out | 8.1919 | C1156Y | None | None | XRAY | 1.7 | 0.208 | 0.232 | A | 327.0 | 293.0 | 17 | 30 | 24 | 6 | [[1116, 1385]] | 1.0 | 5aac | Homo sapiens | TYR_ALK_HUMAN | TYR | 1.9e-90 | 308.6 | 1.0 | 260.0 | 260.0 | 1269 | 1270 | 1271 | 1273 | 1275 | 1150 | 1167 | 1171 | 1246 | 1248 | 1247 | 1249.0 | 1311 | 1299 | 1294 | 1293 | 1292 | 1291 | 1290 | 1289 | 1288 | 1197 | ALK tyrosine kinase receptor |
| TYR | MET | MET_HUMAN | 2WGJA | P08581 | 1052 | 1345 | 1390.0 | VGH:2346 | Type1 | Inactive | DFGin | 5.4186 | 14.21 | BLBplus | -135.65, -156.26 | 47.26, 45.25 | -135.61, 161.65 | 71.89, 90.85 | 65.05, -128.27 | out-out | out | 14.4314 | Saltbr-out | 12.3445 | HRD-in | -73.92, -55.59 | 85.56, -13.18 | out-out-in | SNCooi | out-in | ActLoopNT-out | 10.8902 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -55.61, 121.54 | APE9-dihe-in | -139.09, 151.01 | APE8-dihe-in | -79.04, 70.35 | APE8-rot-na | 28.98 | APE67-dihe-in | -76.22, -0.44 | -56.63, -35.75 | APE12-dist-na | 22.7041 | APE11-dist-na | 17.972 | APE10-dist-na | 17.3403 | APE9-dist-in | 7.1491 | None | None | None | XRAY | 2.0 | 0.215 | 0.232 | A | 306.0 | 290.0 | 4 | 32 | 32 | 0 | [[1078, 1339]] | 1.0 | 2wgj | Homo sapiens | TYR_MET_HUMAN | TYR | 6.7e-92 | 313.6 | 2.0 | 260.0 | 259.0 | 1221 | 1222 | 1223 | 1225 | 1227 | 1110 | 1127 | 1131 | 1201 | 1203 | 1202 | 1204.0 | 1265 | 1253 | 1248 | 1247 | 1246 | 1245 | 1244 | 1243 | 1242 | 1158 | Hepatocyte growth factor receptor |
| TYR | ROS1 | ROS1_HUMAN | 3ZBFA | P08922 | 1934 | 2230 | 2347.0 | VGH:3000 | Type1 | Inactive | DFGin | 6.5532 | 14.5602 | ABAminus | -129.17, -37.91 | -114.96, 123.49 | -118.51, 31.51 | 297.44, 69.18 | -62.83, -16.28 | in-in | in | 8.5059 | Saltbr-in | 3.4994 | HRD-in | -86.85, -45.31 | 73.51, 7.34 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9375 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -30.1 | APE8-dihe-in | -94.83, 74.5 | APE8-rot-na | 33.93 | APE67-dihe-in | -65.41, -17.17 | -63.88, -31.54 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 10.0999 | None | None | None | XRAY | 2.2 | 0.236 | 0.282 | A | 322.0 | 282.0 | 15 | 30 | 18 | 12 | [[1945, 2217]] | 1.0 | 3zbf | Homo sapiens | TYR_ROS1_HUMAN | TYR | 5.4e-95 | 323.5 | 3.0 | 260.0 | 258.0 | 2101 | 2102 | 2103 | 2105 | 2107 | 1980 | 1997 | 2001 | 2076 | 2078 | 2077 | 2079.0 | 2143 | 2131 | 2126 | 2125 | 2124 | 2123 | 2122 | 2121 | 2120 | 2027 | Proto-oncogene tyrosine-protein kinase ROS |
| 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 |
|---|