| 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 | HIPK3 | HIPK3_HUMAN | AF-Q9H422-K1A | Q9H422 | 189 | 533 | 1215.0 | No_ligand | No_ligand | Active | DFGin | 7.4871 | 14.041 | BLAminus | -125.77, 176.15 | 61.94, 65.98 | -75.37, 19.77 | 293.02, 92.39 | -65.47, -27.21 | in-in | in | 8.6679 | Saltbr-in | 2.6869 | HRD-in | -71.68, -44.73 | 63.82, 2.03 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8712 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -115.24, 170.51 | APE9-dihe-na | 62.88, 149.25 | APE8-dihe-in | -66.73, 137.77 | APE8-rot-in | 294.87 | APE67-dihe-in | -67.11, -20.38 | -54.57, -41.77 | APE12-dist-in | 10.3195 | APE11-dist-in | 11.2317 | APE10-dist-in | 7.388 | APE9-dist-in | 3.0987 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 345.0 | 345.0 | 0 | 26 | 26 | 0 | [[197, 525]] | 1.0 | AF-Q9H422-K1 | CMGC_HIPK3_HUMAN | CMGC | 9e-92 | 313.4 | 1.0 | 301.0 | 301.0 | 343 | 344 | 345 | 347 | 349 | 226 | 241 | 245 | 319 | 321 | 320 | 322.0 | 381 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 276 | Homeodomain-interacting protein kinase 3 |
| CMGC | HIPK3 | HIPK3_HUMAN | AF-Q9H422-K3A | Q9H422 | 189 | 533 | 1215.0 | No_ligand | No_ligand | Active | DFGin | 7.2297 | 13.9105 | BLAminus | -130.4, 177.71 | 58.91, 63.77 | -70.14, 17.77 | 295.94, 97.42 | -66.3, -25.05 | in-in | in | 8.666 | Saltbr-in | 2.7127 | HRD-in | -73.64, -43.92 | 65.7, 5.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8792 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.88, 161.33 | APE9-dihe-na | 61.68, 144.54 | APE8-dihe-in | -63.24, 138.57 | APE8-rot-in | 290.89 | APE67-dihe-in | -61.08, -16.33 | -48.36, -60.09 | APE12-dist-in | 10.2214 | APE11-dist-in | 11.0522 | APE10-dist-in | 7.5452 | APE9-dist-in | 3.2379 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 345.0 | 345.0 | 0 | 26 | 26 | 0 | [[197, 525]] | 1.0 | AF-Q9H422-K3 | CMGC_HIPK3_HUMAN | CMGC | 9e-92 | 313.4 | 1.0 | 301.0 | 301.0 | 343 | 344 | 345 | 347 | 349 | 226 | 241 | 245 | 319 | 321 | 320 | 322.0 | 381 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 276 | Homeodomain-interacting protein 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 | HIPK3 | HIPK3_HUMAN | AF-Q9H422-K1A | Q9H422 | 189 | 533 | 1215.0 | No_ligand | No_ligand | Active | DFGin | 7.4871 | 14.041 | BLAminus | -125.77, 176.15 | 61.94, 65.98 | -75.37, 19.77 | 293.02, 92.39 | -65.47, -27.21 | in-in | in | 8.6679 | Saltbr-in | 2.6869 | HRD-in | -71.68, -44.73 | 63.82, 2.03 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8712 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -115.24, 170.51 | APE9-dihe-na | 62.88, 149.25 | APE8-dihe-in | -66.73, 137.77 | APE8-rot-in | 294.87 | APE67-dihe-in | -67.11, -20.38 | -54.57, -41.77 | APE12-dist-in | 10.3195 | APE11-dist-in | 11.2317 | APE10-dist-in | 7.388 | APE9-dist-in | 3.0987 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 345.0 | 345.0 | 0 | 26 | 26 | 0 | [[197, 525]] | 1.0 | AF-Q9H422-K1 | Homo sapiens | CMGC_HIPK3_HUMAN | CMGC | 9e-92 | 313.4 | 1.0 | 301.0 | 301.0 | 343 | 344 | 345 | 347 | 349 | 226 | 241 | 245 | 319 | 321 | 320 | 322.0 | 381 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 276 | Homeodomain-interacting protein kinase 3 |
| CMGC | HIPK3 | HIPK3_HUMAN | AF-Q9H422-K3A | Q9H422 | 189 | 533 | 1215.0 | No_ligand | No_ligand | Active | DFGin | 7.2297 | 13.9105 | BLAminus | -130.4, 177.71 | 58.91, 63.77 | -70.14, 17.77 | 295.94, 97.42 | -66.3, -25.05 | in-in | in | 8.666 | Saltbr-in | 2.7127 | HRD-in | -73.64, -43.92 | 65.7, 5.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8792 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.88, 161.33 | APE9-dihe-na | 61.68, 144.54 | APE8-dihe-in | -63.24, 138.57 | APE8-rot-in | 290.89 | APE67-dihe-in | -61.08, -16.33 | -48.36, -60.09 | APE12-dist-in | 10.2214 | APE11-dist-in | 11.0522 | APE10-dist-in | 7.5452 | APE9-dist-in | 3.2379 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 345.0 | 345.0 | 0 | 26 | 26 | 0 | [[197, 525]] | 1.0 | AF-Q9H422-K3 | Homo sapiens | CMGC_HIPK3_HUMAN | CMGC | 9e-92 | 313.4 | 1.0 | 301.0 | 301.0 | 343 | 344 | 345 | 347 | 349 | 226 | 241 | 245 | 319 | 321 | 320 | 322.0 | 381 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 276 | Homeodomain-interacting protein 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 |
|---|