| 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 | DYRK1A | DYR1A_HUMAN | 3ANRA | Q13627 | 134 | 481 | 763.0 | HRM:1 | Type1 | Active | DFGin | 7.3952 | 14.8796 | BLAminus | -126.97, 175.57 | 62.29, 87.12 | -103.96, 24.02 | 282.74, 80.66 | -67.77, -18.58 | in-in | in | 8.7055 | Saltbr-in | 2.9447 | HRD-in | -59.12, -43.08 | 70.29, -4.2 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.803 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.86, 169.59 | APE9-dihe-na | 72.59, 157.32 | APE8-dihe-in | -74.37, 142.22 | APE8-rot-in | 294.27 | APE67-dihe-in | -55.49, -26.14 | -45.5, -54.94 | APE12-dist-in | 13.813 | APE11-dist-in | 12.0606 | APE10-dist-in | 7.9549 | APE9-dist-in | 3.2535 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | A | 368.0 | 343.0 | 5 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRB | Q13627 | 133 | 481 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.4555 | 14.9313 | BLAminus | -127.37, 175.29 | 64.18, 86.03 | -102.43, 22.55 | 283.14, 80.72 | -64.64, -20.73 | in-in | in | 8.7327 | Saltbr-in | 2.8661 | HRD-in | -58.01, -41.76 | 68.55, -4.63 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9937 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -113.3, 162.51 | APE9-dihe-na | 75.38, 151.66 | APE8-dihe-in | -71.98, 142.21 | APE8-rot-in | 293.97 | APE67-dihe-in | -54.5, -26.35 | -45.44, -54.76 | APE12-dist-in | 13.7489 | APE11-dist-in | 11.8941 | APE10-dist-out | 8.014 | APE9-dist-in | 3.315 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | B | 368.0 | 343.0 | 6 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRC | Q13627 | 134 | 481 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.3517 | 14.8245 | BLAminus | -127.39, 175.73 | 63.91, 86.99 | -105.92, 24.64 | 282.96, 79.27 | -68.52, -18.05 | in-in | in | 8.7205 | Saltbr-in | 2.9637 | HRD-in | -60.25, -41.86 | 68.21, -2.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9578 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -115.38, 158.82 | APE9-dihe-na | 80.57, 155.21 | APE8-dihe-in | -73.66, 142.81 | APE8-rot-in | 291.66 | APE67-dihe-in | -55.43, -28.06 | -45.81, -53.64 | APE12-dist-out | 14.2127 | APE11-dist-in | 12.1151 | APE10-dist-out | 8.2585 | APE9-dist-in | 3.3346 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | C | 368.0 | 338.0 | 10 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRD | Q13627 | 134 | 479 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.4388 | 14.887 | BLAminus | -126.79, 174.71 | 64.81, 86.52 | -103.95, 22.81 | 283.21, 80.12 | -67.2, -17.95 | in-in | in | 8.734 | Saltbr-in | 2.9742 | HRD-in | -61.66, -39.95 | 66.39, -3.38 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8567 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -134.79, 162.98 | APE9-dihe-na | 75.68, 154.5 | APE8-dihe-in | -74.59, 142.8 | APE8-rot-in | 292.67 | APE67-dihe-in | -57.39, -25.31 | -44.77, -54.21 | APE12-dist-out | 14.0346 | APE11-dist-in | 12.1447 | APE10-dist-out | 8.1653 | APE9-dist-in | 3.2451 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | D | 368.0 | 341.0 | 5 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK3 | DYRK3_HUMAN | 5Y86A | O43781 | 138 | 532 | 588.0 | HRM:601 | Type1 | Active | DFGin | 6.8785 | 14.4347 | BLAminus | -121.42, 179.23 | 66.2, 57.54 | -80.8, 21.54 | 289.69, 73.67 | -71.73, -12.45 | in-in | in | 8.7751 | Saltbr-in | 2.7965 | HRD-in | -69.17, -46.88 | 74.51, 0.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.947 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.75, 169.09 | APE9-dihe-na | 75.29, 154.26 | APE8-dihe-in | -74.45, 137.02 | APE8-rot-in | 292.62 | APE67-dihe-in | -59.3, -23.84 | -52.98, -46.9 | APE12-dist-in | 12.6939 | APE11-dist-in | 11.5005 | APE10-dist-in | 7.0456 | APE9-dist-in | 3.0767 | None | SEP350,PTR369,SEP445,TPO512 | SEP350,PTR369,SEP445,TPO512 | XRAY | 1.9 | 0.168 | 0.196 | A | 588.0 | 395.0 | 0 | 25 | 25 | 0 | [[209, 522]] | 1.0 | 5y86 | CMGC_DYRK3_HUMAN | CMGC | 1.8e-97 | 332.3 | 1.0 | 301.0 | 301.0 | 354 | 355 | 356 | 358 | 360 | 238 | 253 | 257 | 332 | 334 | 333 | 335.0 | 391 | 379 | 374 | 373 | 372 | 371 | 370 | 369 | 368 | 289 | Dual specificity tyrosine-phosphorylation-regulated kinase 3 |
| 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 | DYRK1A | DYR1A_HUMAN | 3ANRA | Q13627 | 134 | 481 | 763.0 | HRM:1 | Type1 | Active | DFGin | 7.3952 | 14.8796 | BLAminus | -126.97, 175.57 | 62.29, 87.12 | -103.96, 24.02 | 282.74, 80.66 | -67.77, -18.58 | in-in | in | 8.7055 | Saltbr-in | 2.9447 | HRD-in | -59.12, -43.08 | 70.29, -4.2 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.803 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.86, 169.59 | APE9-dihe-na | 72.59, 157.32 | APE8-dihe-in | -74.37, 142.22 | APE8-rot-in | 294.27 | APE67-dihe-in | -55.49, -26.14 | -45.5, -54.94 | APE12-dist-in | 13.813 | APE11-dist-in | 12.0606 | APE10-dist-in | 7.9549 | APE9-dist-in | 3.2535 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | A | 368.0 | 343.0 | 5 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | Homo sapiens | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRB | Q13627 | 133 | 481 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.4555 | 14.9313 | BLAminus | -127.37, 175.29 | 64.18, 86.03 | -102.43, 22.55 | 283.14, 80.72 | -64.64, -20.73 | in-in | in | 8.7327 | Saltbr-in | 2.8661 | HRD-in | -58.01, -41.76 | 68.55, -4.63 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9937 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -113.3, 162.51 | APE9-dihe-na | 75.38, 151.66 | APE8-dihe-in | -71.98, 142.21 | APE8-rot-in | 293.97 | APE67-dihe-in | -54.5, -26.35 | -45.44, -54.76 | APE12-dist-in | 13.7489 | APE11-dist-in | 11.8941 | APE10-dist-out | 8.014 | APE9-dist-in | 3.315 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | B | 368.0 | 343.0 | 6 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | Homo sapiens | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRC | Q13627 | 134 | 481 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.3517 | 14.8245 | BLAminus | -127.39, 175.73 | 63.91, 86.99 | -105.92, 24.64 | 282.96, 79.27 | -68.52, -18.05 | in-in | in | 8.7205 | Saltbr-in | 2.9637 | HRD-in | -60.25, -41.86 | 68.21, -2.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9578 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -115.38, 158.82 | APE9-dihe-na | 80.57, 155.21 | APE8-dihe-in | -73.66, 142.81 | APE8-rot-in | 291.66 | APE67-dihe-in | -55.43, -28.06 | -45.81, -53.64 | APE12-dist-out | 14.2127 | APE11-dist-in | 12.1151 | APE10-dist-out | 8.2585 | APE9-dist-in | 3.3346 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | C | 368.0 | 338.0 | 10 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | Homo sapiens | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK1A | DYR1A_HUMAN | 3ANRD | Q13627 | 134 | 479 | 763.0 | HRM:1 | Type1 | Inactive | DFGin | 7.4388 | 14.887 | BLAminus | -126.79, 174.71 | 64.81, 86.52 | -103.95, 22.81 | 283.21, 80.12 | -67.2, -17.95 | in-in | in | 8.734 | Saltbr-in | 2.9742 | HRD-in | -61.66, -39.95 | 66.39, -3.38 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8567 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -134.79, 162.98 | APE9-dihe-na | 75.68, 154.5 | APE8-dihe-in | -74.59, 142.8 | APE8-rot-in | 292.67 | APE67-dihe-in | -57.39, -25.31 | -44.77, -54.21 | APE12-dist-out | 14.0346 | APE11-dist-in | 12.1447 | APE10-dist-out | 8.1653 | APE9-dist-in | 3.2451 | None | PTR321 | PTR321 | XRAY | 2.6 | 0.232 | 0.264 | D | 368.0 | 341.0 | 5 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 3anr | Homo sapiens | CMGC_DYRK1A_HUMAN | CMGC | 9e-91 | 310.1 | 1.0 | 301.0 | 301.0 | 306 | 307 | 308 | 310 | 312 | 188 | 203 | 207 | 284 | 286 | 285 | 287.0 | 343 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 239 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A |
| CMGC | DYRK3 | DYRK3_HUMAN | 5Y86A | O43781 | 138 | 532 | 588.0 | HRM:601 | Type1 | Active | DFGin | 6.8785 | 14.4347 | BLAminus | -121.42, 179.23 | 66.2, 57.54 | -80.8, 21.54 | 289.69, 73.67 | -71.73, -12.45 | in-in | in | 8.7751 | Saltbr-in | 2.7965 | HRD-in | -69.17, -46.88 | 74.51, 0.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.947 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.75, 169.09 | APE9-dihe-na | 75.29, 154.26 | APE8-dihe-in | -74.45, 137.02 | APE8-rot-in | 292.62 | APE67-dihe-in | -59.3, -23.84 | -52.98, -46.9 | APE12-dist-in | 12.6939 | APE11-dist-in | 11.5005 | APE10-dist-in | 7.0456 | APE9-dist-in | 3.0767 | None | SEP350,PTR369,SEP445,TPO512 | SEP350,PTR369,SEP445,TPO512 | XRAY | 1.9 | 0.168 | 0.196 | A | 588.0 | 395.0 | 0 | 25 | 25 | 0 | [[209, 522]] | 1.0 | 5y86 | Homo sapiens | CMGC_DYRK3_HUMAN | CMGC | 1.8e-97 | 332.3 | 1.0 | 301.0 | 301.0 | 354 | 355 | 356 | 358 | 360 | 238 | 253 | 257 | 332 | 334 | 333 | 335.0 | 391 | 379 | 374 | 373 | 372 | 371 | 370 | 369 | 368 | 289 | Dual specificity tyrosine-phosphorylation-regulated kinase 3 |
| 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 |
|---|