| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | PIM1 | PIM1_HUMAN | 5KGKA | P11309 | 33 | 305 | 313.0 | 6SD:407 | Type1 | Active | DFGin | 6.3082 | 14.8602 | BLAminus | -128.4, 171.34 | 59.1, 83.1 | -92.34, 16.26 | 283.46, 79.02 | -66.84, -16.78 | in-in | in | 8.9281 | Saltbr-in | 2.7226 | HRD-naA | -66.62, -48.72 | 69.73, 2.6 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8541 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.74, 32.55 | APE9-dihe-na | -90.23, -157.96 | APE8-dihe-in | -86.86, 120.62 | APE8-rot-in | 311.8 | APE67-dihe-in | -66.57, -13.56 | -54.03, -44.15 | APE12-dist-in | 9.7032 | APE11-dist-in | 8.8498 | APE10-dist-in | 5.6821 | APE9-dist-in | 3.7634 | None | None | None | XRAY | 2.66 | 0.188 | 0.206 | A | 276.0 | 273.0 | 0 | 26 | 26 | 0 | [[38, 290]] | 1.0 | 5kgk | CAMK_PIM1_HUMAN | CAMK | 2.5e-65 | 226.2 | 1.0 | 256.0 | 256.0 | 185 | 186 | 187 | 189 | 191 | 67 | 89 | 93 | 164 | 166 | 165 | 167.0 | 224 | 211 | 206 | 205 | 204 | 203 | 202 | 201 | 200 | 121 | Serine/threonine-protein kinase pim-1 |
| CMGC | DYRK1A | DYR1A_HUMAN | 7A4ZA | Q13627 | 148 | 481 | 763.0 | 6SD:60501 | Type1 | Active | DFGin | 7.3003 | 14.4561 | BLAminus | -123.85, 174.34 | 70.88, 81.03 | -96.04, 32.37 | 287.17, 75.22 | -72.9, -22.44 | in-in | in | 8.5921 | Saltbr-in | 2.7044 | HRD-in | -62.51, -50.76 | 77.01, -4.38 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8459 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.05, 171.4 | APE9-dihe-na | 73.73, 155.23 | APE8-dihe-in | -74.89, 141.08 | APE8-rot-in | 296.68 | APE67-dihe-in | -55.98, -24.62 | -56.22, -49.4 | APE12-dist-in | 12.8905 | APE11-dist-in | 11.2253 | APE10-dist-in | 6.8866 | APE9-dist-in | 3.0483 | None | PTR321 | PTR321 | XRAY | 1.9 | 0.175 | 0.215 | A | 359.0 | 330.0 | 4 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 7a4z | CMGC_DYRK1A_HUMAN | CMGC | 8.2e-91 | 310.2 | 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 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | PIM1 | PIM1_HUMAN | 5KGKA | P11309 | 33 | 305 | 313.0 | 6SD:407 | Type1 | Active | DFGin | 6.3082 | 14.8602 | BLAminus | -128.4, 171.34 | 59.1, 83.1 | -92.34, 16.26 | 283.46, 79.02 | -66.84, -16.78 | in-in | in | 8.9281 | Saltbr-in | 2.7226 | HRD-naA | -66.62, -48.72 | 69.73, 2.6 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8541 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.74, 32.55 | APE9-dihe-na | -90.23, -157.96 | APE8-dihe-in | -86.86, 120.62 | APE8-rot-in | 311.8 | APE67-dihe-in | -66.57, -13.56 | -54.03, -44.15 | APE12-dist-in | 9.7032 | APE11-dist-in | 8.8498 | APE10-dist-in | 5.6821 | APE9-dist-in | 3.7634 | None | None | None | XRAY | 2.66 | 0.188 | 0.206 | A | 276.0 | 273.0 | 0 | 26 | 26 | 0 | [[38, 290]] | 1.0 | 5kgk | Homo sapiens | CAMK_PIM1_HUMAN | CAMK | 2.5e-65 | 226.2 | 1.0 | 256.0 | 256.0 | 185 | 186 | 187 | 189 | 191 | 67 | 89 | 93 | 164 | 166 | 165 | 167.0 | 224 | 211 | 206 | 205 | 204 | 203 | 202 | 201 | 200 | 121 | Serine/threonine-protein kinase pim-1 |
| CMGC | DYRK1A | DYR1A_HUMAN | 7A4ZA | Q13627 | 148 | 481 | 763.0 | 6SD:60501 | Type1 | Active | DFGin | 7.3003 | 14.4561 | BLAminus | -123.85, 174.34 | 70.88, 81.03 | -96.04, 32.37 | 287.17, 75.22 | -72.9, -22.44 | in-in | in | 8.5921 | Saltbr-in | 2.7044 | HRD-in | -62.51, -50.76 | 77.01, -4.38 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8459 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.05, 171.4 | APE9-dihe-na | 73.73, 155.23 | APE8-dihe-in | -74.89, 141.08 | APE8-rot-in | 296.68 | APE67-dihe-in | -55.98, -24.62 | -56.22, -49.4 | APE12-dist-in | 12.8905 | APE11-dist-in | 11.2253 | APE10-dist-in | 6.8866 | APE9-dist-in | 3.0483 | None | PTR321 | PTR321 | XRAY | 1.9 | 0.175 | 0.215 | A | 359.0 | 330.0 | 4 | 25 | 25 | 0 | [[159, 479]] | 1.0 | 7a4z | Homo sapiens | CMGC_DYRK1A_HUMAN | CMGC | 8.2e-91 | 310.2 | 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 |
| 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 |
|---|