| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | AKT1 | AKT1_HUMAN | 3MV5A | P31749 | 144 | 477 | 480.0 | XFE:60999 | Type1 | Active | DFGin | 6.5116 | 13.1066 | BLAminus | -110.68, 173.87 | 55.61, 106.15 | -116.13, 8.16 | 292.02, 88.05 | -68.88, -21.78 | in-in | in | 8.5726 | Saltbr-in | 2.6452 | HRD-in | -81.07, -37.62 | 75.3, -21.62 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9426 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -163.23, 167.83 | APE9-dihe-na | 126.38, -137.1 | APE8-dihe-in | -133.69, 127.23 | APE8-rot-in | 287.39 | APE67-dihe-in | -69.19, -14.76 | -48.38, -39.25 | APE12-dist-in | 8.4675 | APE11-dist-in | 11.6919 | APE10-dist-in | 6.145 | APE9-dist-in | 4.1852 | S473D | TPO308 | TPO308 | XRAY | 2.47 | 0.205 | 0.282 | A | 342.0 | 316.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3mv5 | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | AKT1 | AKT1_HUMAN | 3MVHA | P31749 | 145 | 476 | 480.0 | WFE:999 | Type1 | Active | DFGin | 6.6088 | 13.2047 | BLAminus | -120.33, 157.64 | 77.18, 89.81 | -109.14, 14.39 | 295.05, 87.49 | -62.89, -24.97 | in-in | in | 8.782 | Saltbr-in | 2.6198 | HRD-in | -82.77, -44.94 | 75.58, -15.19 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8364 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.65, 167.39 | APE9-dihe-na | 135.14, -139.29 | APE8-dihe-in | -137.11, 131.02 | APE8-rot-in | 291.39 | APE67-dihe-in | -63.24, -17.86 | -53.88, -42.66 | APE12-dist-in | 8.1485 | APE11-dist-in | 11.5909 | APE10-dist-in | 5.8546 | APE9-dist-in | 3.7556 | S473D | TPO308 | TPO308 | XRAY | 2.01 | 0.181 | 0.23 | A | 342.0 | 312.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3mvh | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | PRKACA | KAPCA_HUMAN | 3MVJA | P17612 | 16 | 351 | 351.0 | XFE:60351 | Type1 | Active | DFGin | 6.1884 | 13.5821 | BLAminus | -115.88, 169.36 | 72.34, 84.05 | -100.4, 21.07 | 284.54, 72.78 | -48.33, -32.34 | in-in | in | 8.6933 | Saltbr-in | 2.9429 | HRD-in | -94.45, -57.98 | 81.77, 7.12 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0047 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.5, 165.11 | APE9-dihe-na | 130.23, -153.23 | APE8-dihe-in | -130.91, 127.14 | APE8-rot-in | 305.92 | APE67-dihe-in | -54.4, -32.7 | -46.27, -53.24 | APE12-dist-in | 8.1645 | APE11-dist-in | 11.4405 | APE10-dist-in | 5.835 | APE9-dist-in | 3.6782 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 2.49 | 0.217 | 0.304 | A | 371.0 | 336.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 3mvj | AGC_PRKACA_HUMAN | AGC | 5.4e-95 | 323.5 | 1.0 | 260.0 | 260.0 | 184 | 185 | 186 | 188 | 190 | 73 | 92 | 96 | 164 | 166 | 165 | 167.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 122 | cAMP-dependent protein kinase catalytic subunit alpha |
| AGC | PRKACA | KAPCA_HUMAN | 3MVJE | P17612 | 16 | 351 | 351.0 | XFE:60351 | Type1 | Active | DFGin | 6.0097 | 13.9041 | BLAminus | -120.77, 173.49 | 75.79, 91.53 | -105.05, 22.03 | 286.9, 73.04 | -48.68, -45.44 | in-in | in | 8.7857 | Saltbr-in | 2.5037 | HRD-in | -85.62, -59.75 | 66.22, 15.9 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9875 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.99, 156.89 | APE9-dihe-na | 143.78, -161.15 | APE8-dihe-in | -124.44, 132.79 | APE8-rot-in | 305.29 | APE67-dihe-in | -69.91, -25.33 | -54.9, -34.25 | APE12-dist-in | 8.1481 | APE11-dist-in | 11.447 | APE10-dist-in | 5.8027 | APE9-dist-in | 3.8015 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 2.49 | 0.217 | 0.304 | E | 371.0 | 336.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 3mvj | AGC_PRKACA_HUMAN | AGC | 5.4e-95 | 323.5 | 1.0 | 260.0 | 260.0 | 184 | 185 | 186 | 188 | 190 | 73 | 92 | 96 | 164 | 166 | 165 | 167.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 122 | cAMP-dependent protein kinase catalytic subunit alpha |
| CAMK | CHEK1 | CHK1_HUMAN | 5OP5A | O14757 | 4 | 270 | 476.0 | 3FE:301 | Type1 | Active | DFGin | 7.1428 | 13.6564 | BLAminus | -111.04, 162.46 | 74.82, 99.79 | -113.07, 20.16 | 292.98, 78.11 | -70.13, -26.75 | in-in | in | 9.3938 | Saltbr-in | 2.8937 | HRD-in | -76.35, -46.93 | 73.16, 0.06 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8807 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.71, 173.57 | APE9-dihe-na | 115.19, -153.36 | APE8-dihe-in | -133.92, 122.39 | APE8-rot-in | 297.32 | APE67-dihe-in | -67.39, -15.82 | -48.27, -44.76 | APE12-dist-in | 8.8647 | APE11-dist-in | 11.7064 | APE10-dist-in | 6.2154 | APE9-dist-in | 3.4081 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S | None | None | XRAY | 1.9 | 0.162 | 0.206 | A | 297.0 | 259.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5op5 | CAMK_CHEK1_HUMAN | CAMK | 4.8e-69 | 238.4 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| CMGC | CDK8 | CDK8_HUMAN | 6T41A | P49336 | 1 | 359 | 464.0 | MFE:60501 | Type1 | Inactive | DFGin | 8.6301 | 13.5154 | BLBminus | -130.72, 167.87 | 65.4, 35.77 | -47.77, 142.68 | 290.97, 94.77 | -79.52, 87.36 | in-in | in | 9.2255 | Saltbr-in | 2.9666 | HRD-in | -82.44, -61.41 | 81.57, -4.44 | in-out-out | SNCioo | out-out | ActLoopNT-out | 8.8749 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 161.03 | APE8-rot-out | 58.35 | APE67-dihe-in | -69.81, -18.57 | -101.28, 19.75 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.185 | 0.256 | A | 407.0 | 343.0 | 16 | 31 | 22 | 9 | [[22, 335]] | 1.0 | 6t41 | CMGC_CDK8_HUMAN | CMGC | 6e-82 | 281.3 | 5.0 | 301.0 | 297.0 | 172 | 173 | 174 | 176 | 178 | 52 | 66 | 70 | 148 | 150 | 149 | 151.0 | 216 | 203 | 198 | 197 | 196 | 195 | 194 | 193 | 192 | 98 | Cyclin-dependent kinase 8 |
| STE | STK24 | STK24_HUMAN | 4U8ZA | Q9Y6E0 | 24 | 310 | 443.0 | 3FE:60302 | Type1 | Active | DFGin | 6.5278 | 14.9005 | BLAminus | -128.43, 174.12 | 66.34, 76.3 | -95.1, 25.22 | 282.31, 81.0 | -59.44, -28.27 | in-in | in | 9.0361 | Saltbr-in | 2.6301 | HRD-in | -65.44, -50.67 | 72.91, -5.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7833 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.77, 152.23 | APE9-dihe-na | 127.25, -169.58 | APE8-dihe-in | -108.68, 117.12 | APE8-rot-in | 308.93 | APE67-dihe-in | -55.79, -29.55 | -30.8, -59.22 | APE12-dist-in | 8.4586 | APE11-dist-in | 10.7477 | APE10-dist-in | 4.9384 | APE9-dist-in | 3.4404 | None | TPO190 | TPO190 | XRAY | 1.63 | 0.192 | 0.222 | A | 290.0 | 287.0 | 0 | 28 | 28 | 0 | [[36, 286]] | 1.0 | 4u8z | STE_STK24_HUMAN | STE | 3.1e-100 | 340.7 | 1.0 | 257.0 | 257.0 | 173 | 174 | 175 | 177 | 179 | 65 | 82 | 86 | 153 | 155 | 154 | 156.0 | 213 | 201 | 196 | 195 | 194 | 193 | 192 | 191 | 190 | 112 | Serine/threonine-protein kinase 24 |
| TYR | SYK | KSYK_HUMAN | 6ZCSA | P43405 | 363 | 635 | 635.0 | QFE:60701 | Type1 | None | DFGin | 6.4231 | 14.5156 | BLAminus | -134.38, -165.15 | 61.58, 75.97 | -101.01, 19.73 | 286.51, 84.39 | -60.24, -29.14 | in-in | in | 8.0858 | Saltbr-in | 2.9668 | HRD-in | -75.9, -52.9 | 70.28, 10.24 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9526 | ActLoopCT-none | TYR | APEdihe_niiai | APEdist_aaai | APE10-dihe-none | 999.0, 129.22 | APE9-dihe-in | -113.36, 141.08 | APE8-dihe-in | -78.2, 72.25 | APE8-rot-na | 29.63 | APE67-dihe-in | -66.52, -13.86 | -50.21, -39.33 | APE12-dist-na | 13.3749 | APE11-dist-na | 999.0 | APE10-dist-na | 11.3069 | APE9-dist-in | 7.0916 | None | None | None | XRAY | 1.47 | 0.191 | 0.208 | A | 299.0 | 267.0 | 6 | 31 | 30 | 1 | [[370, 628]] | 1.0 | 6zcs | TYR_SYK_HUMAN | TYR | 6.1e-90 | 307.0 | 5.0 | 260.0 | 256.0 | 511 | 512 | 513 | 515 | 517 | 402 | 420 | 424 | 491 | 493 | 492 | 494.0 | 554 | 542 | 537 | 536 | 535 | 534 | 533 | 532 | 531 | 449 | Tyrosine-protein kinase SYK |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | AKT1 | AKT1_HUMAN | 3MV5A | P31749 | 144 | 477 | 480.0 | XFE:60999 | Type1 | Active | DFGin | 6.5116 | 13.1066 | BLAminus | -110.68, 173.87 | 55.61, 106.15 | -116.13, 8.16 | 292.02, 88.05 | -68.88, -21.78 | in-in | in | 8.5726 | Saltbr-in | 2.6452 | HRD-in | -81.07, -37.62 | 75.3, -21.62 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9426 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -163.23, 167.83 | APE9-dihe-na | 126.38, -137.1 | APE8-dihe-in | -133.69, 127.23 | APE8-rot-in | 287.39 | APE67-dihe-in | -69.19, -14.76 | -48.38, -39.25 | APE12-dist-in | 8.4675 | APE11-dist-in | 11.6919 | APE10-dist-in | 6.145 | APE9-dist-in | 4.1852 | S473D | TPO308 | TPO308 | XRAY | 2.47 | 0.205 | 0.282 | A | 342.0 | 316.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3mv5 | Homo sapiens | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | AKT1 | AKT1_HUMAN | 3MVHA | P31749 | 145 | 476 | 480.0 | WFE:999 | Type1 | Active | DFGin | 6.6088 | 13.2047 | BLAminus | -120.33, 157.64 | 77.18, 89.81 | -109.14, 14.39 | 295.05, 87.49 | -62.89, -24.97 | in-in | in | 8.782 | Saltbr-in | 2.6198 | HRD-in | -82.77, -44.94 | 75.58, -15.19 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8364 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.65, 167.39 | APE9-dihe-na | 135.14, -139.29 | APE8-dihe-in | -137.11, 131.02 | APE8-rot-in | 291.39 | APE67-dihe-in | -63.24, -17.86 | -53.88, -42.66 | APE12-dist-in | 8.1485 | APE11-dist-in | 11.5909 | APE10-dist-in | 5.8546 | APE9-dist-in | 3.7556 | S473D | TPO308 | TPO308 | XRAY | 2.01 | 0.181 | 0.23 | A | 342.0 | 312.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3mvh | Homo sapiens | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | PRKACA | KAPCA_HUMAN | 3MVJA | P17612 | 16 | 351 | 351.0 | XFE:60351 | Type1 | Active | DFGin | 6.1884 | 13.5821 | BLAminus | -115.88, 169.36 | 72.34, 84.05 | -100.4, 21.07 | 284.54, 72.78 | -48.33, -32.34 | in-in | in | 8.6933 | Saltbr-in | 2.9429 | HRD-in | -94.45, -57.98 | 81.77, 7.12 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0047 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.5, 165.11 | APE9-dihe-na | 130.23, -153.23 | APE8-dihe-in | -130.91, 127.14 | APE8-rot-in | 305.92 | APE67-dihe-in | -54.4, -32.7 | -46.27, -53.24 | APE12-dist-in | 8.1645 | APE11-dist-in | 11.4405 | APE10-dist-in | 5.835 | APE9-dist-in | 3.6782 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 2.49 | 0.217 | 0.304 | A | 371.0 | 336.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 3mvj | Homo sapiens | AGC_PRKACA_HUMAN | AGC | 5.4e-95 | 323.5 | 1.0 | 260.0 | 260.0 | 184 | 185 | 186 | 188 | 190 | 73 | 92 | 96 | 164 | 166 | 165 | 167.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 122 | cAMP-dependent protein kinase catalytic subunit alpha |
| AGC | PRKACA | KAPCA_HUMAN | 3MVJE | P17612 | 16 | 351 | 351.0 | XFE:60351 | Type1 | Active | DFGin | 6.0097 | 13.9041 | BLAminus | -120.77, 173.49 | 75.79, 91.53 | -105.05, 22.03 | 286.9, 73.04 | -48.68, -45.44 | in-in | in | 8.7857 | Saltbr-in | 2.5037 | HRD-in | -85.62, -59.75 | 66.22, 15.9 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9875 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.99, 156.89 | APE9-dihe-na | 143.78, -161.15 | APE8-dihe-in | -124.44, 132.79 | APE8-rot-in | 305.29 | APE67-dihe-in | -69.91, -25.33 | -54.9, -34.25 | APE12-dist-in | 8.1481 | APE11-dist-in | 11.447 | APE10-dist-in | 5.8027 | APE9-dist-in | 3.8015 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 2.49 | 0.217 | 0.304 | E | 371.0 | 336.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 3mvj | Homo sapiens | AGC_PRKACA_HUMAN | AGC | 5.4e-95 | 323.5 | 1.0 | 260.0 | 260.0 | 184 | 185 | 186 | 188 | 190 | 73 | 92 | 96 | 164 | 166 | 165 | 167.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 122 | cAMP-dependent protein kinase catalytic subunit alpha |
| CAMK | CHEK1 | CHK1_HUMAN | 5OP5A | O14757 | 4 | 270 | 476.0 | 3FE:301 | Type1 | Active | DFGin | 7.1428 | 13.6564 | BLAminus | -111.04, 162.46 | 74.82, 99.79 | -113.07, 20.16 | 292.98, 78.11 | -70.13, -26.75 | in-in | in | 9.3938 | Saltbr-in | 2.8937 | HRD-in | -76.35, -46.93 | 73.16, 0.06 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8807 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.71, 173.57 | APE9-dihe-na | 115.19, -153.36 | APE8-dihe-in | -133.92, 122.39 | APE8-rot-in | 297.32 | APE67-dihe-in | -67.39, -15.82 | -48.27, -44.76 | APE12-dist-in | 8.8647 | APE11-dist-in | 11.7064 | APE10-dist-in | 6.2154 | APE9-dist-in | 3.4081 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S | None | None | XRAY | 1.9 | 0.162 | 0.206 | A | 297.0 | 259.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5op5 | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 4.8e-69 | 238.4 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| CMGC | CDK8 | CDK8_HUMAN | 6T41A | P49336 | 1 | 359 | 464.0 | MFE:60501 | Type1 | Inactive | DFGin | 8.6301 | 13.5154 | BLBminus | -130.72, 167.87 | 65.4, 35.77 | -47.77, 142.68 | 290.97, 94.77 | -79.52, 87.36 | in-in | in | 9.2255 | Saltbr-in | 2.9666 | HRD-in | -82.44, -61.41 | 81.57, -4.44 | in-out-out | SNCioo | out-out | ActLoopNT-out | 8.8749 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 161.03 | APE8-rot-out | 58.35 | APE67-dihe-in | -69.81, -18.57 | -101.28, 19.75 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.185 | 0.256 | A | 407.0 | 343.0 | 16 | 31 | 22 | 9 | [[22, 335]] | 1.0 | 6t41 | Homo sapiens | CMGC_CDK8_HUMAN | CMGC | 6e-82 | 281.3 | 5.0 | 301.0 | 297.0 | 172 | 173 | 174 | 176 | 178 | 52 | 66 | 70 | 148 | 150 | 149 | 151.0 | 216 | 203 | 198 | 197 | 196 | 195 | 194 | 193 | 192 | 98 | Cyclin-dependent kinase 8 |
| STE | STK24 | STK24_HUMAN | 4U8ZA | Q9Y6E0 | 24 | 310 | 443.0 | 3FE:60302 | Type1 | Active | DFGin | 6.5278 | 14.9005 | BLAminus | -128.43, 174.12 | 66.34, 76.3 | -95.1, 25.22 | 282.31, 81.0 | -59.44, -28.27 | in-in | in | 9.0361 | Saltbr-in | 2.6301 | HRD-in | -65.44, -50.67 | 72.91, -5.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7833 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.77, 152.23 | APE9-dihe-na | 127.25, -169.58 | APE8-dihe-in | -108.68, 117.12 | APE8-rot-in | 308.93 | APE67-dihe-in | -55.79, -29.55 | -30.8, -59.22 | APE12-dist-in | 8.4586 | APE11-dist-in | 10.7477 | APE10-dist-in | 4.9384 | APE9-dist-in | 3.4404 | None | TPO190 | TPO190 | XRAY | 1.63 | 0.192 | 0.222 | A | 290.0 | 287.0 | 0 | 28 | 28 | 0 | [[36, 286]] | 1.0 | 4u8z | Homo sapiens | STE_STK24_HUMAN | STE | 3.1e-100 | 340.7 | 1.0 | 257.0 | 257.0 | 173 | 174 | 175 | 177 | 179 | 65 | 82 | 86 | 153 | 155 | 154 | 156.0 | 213 | 201 | 196 | 195 | 194 | 193 | 192 | 191 | 190 | 112 | Serine/threonine-protein kinase 24 |
| TYR | SYK | KSYK_HUMAN | 6ZCSA | P43405 | 363 | 635 | 635.0 | QFE:60701 | Type1 | None | DFGin | 6.4231 | 14.5156 | BLAminus | -134.38, -165.15 | 61.58, 75.97 | -101.01, 19.73 | 286.51, 84.39 | -60.24, -29.14 | in-in | in | 8.0858 | Saltbr-in | 2.9668 | HRD-in | -75.9, -52.9 | 70.28, 10.24 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9526 | ActLoopCT-none | TYR | APEdihe_niiai | APEdist_aaai | APE10-dihe-none | 999.0, 129.22 | APE9-dihe-in | -113.36, 141.08 | APE8-dihe-in | -78.2, 72.25 | APE8-rot-na | 29.63 | APE67-dihe-in | -66.52, -13.86 | -50.21, -39.33 | APE12-dist-na | 13.3749 | APE11-dist-na | 999.0 | APE10-dist-na | 11.3069 | APE9-dist-in | 7.0916 | None | None | None | XRAY | 1.47 | 0.191 | 0.208 | A | 299.0 | 267.0 | 6 | 31 | 30 | 1 | [[370, 628]] | 1.0 | 6zcs | Homo sapiens | TYR_SYK_HUMAN | TYR | 6.1e-90 | 307.0 | 5.0 | 260.0 | 256.0 | 511 | 512 | 513 | 515 | 517 | 402 | 420 | 424 | 491 | 493 | 492 | 494.0 | 554 | 542 | 537 | 536 | 535 | 534 | 533 | 532 | 531 | 449 | Tyrosine-protein kinase SYK |
| AGC | RPS6KA3-1 | KS6A3_MOUSE | 4EL9A | P18654 | 49 | 346 | 740.0 | AFE:400 | Type1 | Inactive | DFGout | 22.3948 | 9.8077 | None | -73.23, 140.2 | -88.81, 8.12 | -121.45, 151.95 | 53.82, 95.87 | -80.4, 148.97 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -73.14, -47.46 | 84.19, -56.79 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 15.3124 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioo | APE10-dihe-na | -117.53, 106.32 | APE9-dihe-na | -111.78, 156.34 | APE8-dihe-in | -73.67, 109.22 | APE8-rot-in | 303.69 | APE67-dihe-in | -56.7, -22.51 | -55.9, -38.19 | APE12-dist-out | 14.0619 | APE11-dist-in | 11.6291 | APE10-dist-out | 10.074 | APE9-dist-out | 6.8591 | None | None | None | XRAY | 1.55 | 0.226 | 0.226 | A | 305.0 | 290.0 | 8 | 28 | 25 | 3 | [[68, 327], [422, 679]] | 2.0 | 4el9 | Mus musculus | AGC_RPS6KA3-1_MOUSE | AGC | 2.1e-97 | 331.2 | 1.0 | 260.0 | 260.0 | 210 | 211 | 212 | 214 | 216 | 100 | 118 | 122 | 190 | 192 | 191 | 193.0 | 250 | 238 | 233 | 232 | 231 | 230 | 229 | 228 | 227 | 148 | Ribosomal protein S6 kinase alpha-3 |
| OTHER | PKNG | PKNG_MYCTU | 7Q52AAA | P9WI73 | 87 | 404 | 750.0 | FE:60401,8ZC:60402 | Allosteric,Type1 | Inactive | DFGin | 7.0581 | 11.2564 | ABAminus | -119.82, -27.71 | -109.4, 111.2 | -104.78, 13.6 | 300.05, 6.27 | -67.88, -19.56 | out-out | out | 14.7713 | Saltbr-out | 15.0526 | HRD-out | -99.82, 97.23 | -80.15, -4.98 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8855 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.45, 94.89 | APE9-dihe-na | 105.61, 168.23 | APE8-dihe-in | -79.1, 126.61 | APE8-rot-in | 308.67 | APE67-dihe-inflip | 91.4, -14.28 | -58.76, 146.4 | APE12-dist-in | 11.3281 | APE11-dist-in | 8.5942 | APE10-dist-in | 5.1471 | APE9-dist-in | 3.8439 | None | None | None | XRAY | 2.35 | 0.218 | 0.268 | AAA | 333.0 | 312.0 | 0 | 24 | 24 | 0 | [[151, 345]] | 1.0 | 7q52 | Mycobacterium tuberculosis | OTHER_PKNG_MYCTU | CAMK | 6.1e-22 | 86.5 | 1.0 | 186.0 | 186.0 | 292 | 293 | 294 | 296 | 298 | 181 | 198 | 202 | 273 | 275 | 274 | 276.0 | 327 | 316 | 311 | 310 | 309 | 308 | 307 | 306 | 305 | 233 | Serine/threonine-protein kinase PknG |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | RPS6KA3-1 | KS6A3_MOUSE | 4EL9A | P18654 | 49 | 346 | 740.0 | AFE:400 | Type1 | Inactive | DFGout | 22.3948 | 9.8077 | None | -73.23, 140.2 | -88.81, 8.12 | -121.45, 151.95 | 53.82, 95.87 | -80.4, 148.97 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -73.14, -47.46 | 84.19, -56.79 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 15.3124 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioo | APE10-dihe-na | -117.53, 106.32 | APE9-dihe-na | -111.78, 156.34 | APE8-dihe-in | -73.67, 109.22 | APE8-rot-in | 303.69 | APE67-dihe-in | -56.7, -22.51 | -55.9, -38.19 | APE12-dist-out | 14.0619 | APE11-dist-in | 11.6291 | APE10-dist-out | 10.074 | APE9-dist-out | 6.8591 | None | None | None | XRAY | 1.55 | 0.226 | 0.226 | A | 305.0 | 290.0 | 8 | 28 | 25 | 3 | [[68, 327], [422, 679]] | 2.0 | 4el9 | Mus musculus | AGC_RPS6KA3-1_MOUSE | AGC | 2.1e-97 | 331.2 | 1.0 | 260.0 | 260.0 | 210 | 211 | 212 | 214 | 216 | 100 | 118 | 122 | 190 | 192 | 191 | 193.0 | 250 | 238 | 233 | 232 | 231 | 230 | 229 | 228 | 227 | 148 | Ribosomal protein S6 kinase alpha-3 |
| OTHER | PKNG | PKNG_MYCTU | 7Q52AAA | P9WI73 | 87 | 404 | 750.0 | FE:60401,8ZC:60402 | Allosteric,Type1 | Inactive | DFGin | 7.0581 | 11.2564 | ABAminus | -119.82, -27.71 | -109.4, 111.2 | -104.78, 13.6 | 300.05, 6.27 | -67.88, -19.56 | out-out | out | 14.7713 | Saltbr-out | 15.0526 | HRD-out | -99.82, 97.23 | -80.15, -4.98 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8855 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.45, 94.89 | APE9-dihe-na | 105.61, 168.23 | APE8-dihe-in | -79.1, 126.61 | APE8-rot-in | 308.67 | APE67-dihe-inflip | 91.4, -14.28 | -58.76, 146.4 | APE12-dist-in | 11.3281 | APE11-dist-in | 8.5942 | APE10-dist-in | 5.1471 | APE9-dist-in | 3.8439 | None | None | None | XRAY | 2.35 | 0.218 | 0.268 | AAA | 333.0 | 312.0 | 0 | 24 | 24 | 0 | [[151, 345]] | 1.0 | 7q52 | Mycobacterium tuberculosis | OTHER_PKNG_MYCTU | CAMK | 6.1e-22 | 86.5 | 1.0 | 186.0 | 186.0 | 292 | 293 | 294 | 296 | 298 | 181 | 198 | 202 | 273 | 275 | 274 | 276.0 | 327 | 316 | 311 | 310 | 309 | 308 | 307 | 306 | 305 | 233 | Serine/threonine-protein kinase PknG |