| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | TNIK | TNIK_HUMAN | 5CWZA | Q9UKE5 | 11 | 307 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2972 | 13.0273 | BLBplus | -131.93, 171.39 | 52.81, 50.01 | -93.78, 159.27 | 56.53, 92.13 | 73.7, -18.06 | in-out | in | 9.7354 | Saltbr-out | 5.033 | HRD-in | -66.69, -49.97 | 81.58, -13.57 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioo | APE10-dihe-na | -103.92, -173.6 | APE9-dihe-na | -147.95, -142.69 | APE8-dihe-in | -80.43, 117.21 | APE8-rot-out | 64.06 | APE67-dihe-in | -55.24, -35.12 | -86.57, -14.76 | APE12-dist-out | 16.9035 | APE11-dist-in | 13.9474 | APE10-dist-out | 15.4081 | APE9-dist-out | 10.2212 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | A | 308.0 | 284.0 | 13 | 28 | 17 | 11 | [[25, 289]] | 1.0 | 5cwz | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| STE | TNIK | TNIK_HUMAN | 5CWZB | Q9UKE5 | 11 | 307 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2418 | 13.058 | BLBplus | -127.34, 168.87 | 49.84, 48.4 | -92.81, 156.83 | 61.46, 92.74 | 77.66, -28.77 | in-out | in | 9.9582 | Saltbr-out | 5.3812 | HRD-in | -70.33, -45.7 | 76.86, 11.4 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -132.33, 127.61 | APE9-dihe-na | -72.86, -149.09 | APE8-dihe-in | -89.35, 128.31 | APE8-rot-out | 81.47 | APE67-dihe-in | -55.03, -25.43 | -80.73, -20.88 | APE12-dist-out | 16.688 | APE11-dist-out | 14.1255 | APE10-dist-out | 15.9336 | APE9-dist-out | 9.3214 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | B | 308.0 | 284.0 | 13 | 28 | 17 | 11 | [[25, 289]] | 1.0 | 5cwz | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| STE | TNIK | TNIK_HUMAN | 5CWZC | Q9UKE5 | 15 | 308 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.656 | 13.2402 | BLBplus | -127.63, 168.75 | 47.28, 57.4 | -101.13, 171.79 | 53.59, 90.46 | 67.6, -60.94 | in-in | in | 9.1786 | Saltbr-in | 3.5762 | HRD-in | -65.47, -36.96 | 66.37, 3.69 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -108.04 | APE8-dihe-in | -110.03, 122.67 | APE8-rot-out | 53.24 | APE67-dihe-in | -62.79, -15.37 | -94.77, 17.14 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.4475 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | C | 308.0 | 271.0 | 23 | 28 | 13 | 15 | [[25, 289]] | 1.0 | 5cwz | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | TNIK | TNIK_HUMAN | 5CWZA | Q9UKE5 | 11 | 307 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2972 | 13.0273 | BLBplus | -131.93, 171.39 | 52.81, 50.01 | -93.78, 159.27 | 56.53, 92.13 | 73.7, -18.06 | in-out | in | 9.7354 | Saltbr-out | 5.033 | HRD-in | -66.69, -49.97 | 81.58, -13.57 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioo | APE10-dihe-na | -103.92, -173.6 | APE9-dihe-na | -147.95, -142.69 | APE8-dihe-in | -80.43, 117.21 | APE8-rot-out | 64.06 | APE67-dihe-in | -55.24, -35.12 | -86.57, -14.76 | APE12-dist-out | 16.9035 | APE11-dist-in | 13.9474 | APE10-dist-out | 15.4081 | APE9-dist-out | 10.2212 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | A | 308.0 | 284.0 | 13 | 28 | 17 | 11 | [[25, 289]] | 1.0 | 5cwz | Homo sapiens | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| STE | TNIK | TNIK_HUMAN | 5CWZB | Q9UKE5 | 11 | 307 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2418 | 13.058 | BLBplus | -127.34, 168.87 | 49.84, 48.4 | -92.81, 156.83 | 61.46, 92.74 | 77.66, -28.77 | in-out | in | 9.9582 | Saltbr-out | 5.3812 | HRD-in | -70.33, -45.7 | 76.86, 11.4 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -132.33, 127.61 | APE9-dihe-na | -72.86, -149.09 | APE8-dihe-in | -89.35, 128.31 | APE8-rot-out | 81.47 | APE67-dihe-in | -55.03, -25.43 | -80.73, -20.88 | APE12-dist-out | 16.688 | APE11-dist-out | 14.1255 | APE10-dist-out | 15.9336 | APE9-dist-out | 9.3214 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | B | 308.0 | 284.0 | 13 | 28 | 17 | 11 | [[25, 289]] | 1.0 | 5cwz | Homo sapiens | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| STE | TNIK | TNIK_HUMAN | 5CWZC | Q9UKE5 | 15 | 308 | 1360.0 | No_ligand | No_ligand | Inactive | DFGin | 4.656 | 13.2402 | BLBplus | -127.63, 168.75 | 47.28, 57.4 | -101.13, 171.79 | 53.59, 90.46 | 67.6, -60.94 | in-in | in | 9.1786 | Saltbr-in | 3.5762 | HRD-in | -65.47, -36.96 | 66.37, 3.69 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -108.04 | APE8-dihe-in | -110.03, 122.67 | APE8-rot-out | 53.24 | APE67-dihe-in | -62.79, -15.37 | -94.77, 17.14 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.4475 | None | None | None | XRAY | 2.9 | 0.212 | 0.281 | C | 308.0 | 271.0 | 23 | 28 | 13 | 15 | [[25, 289]] | 1.0 | 5cwz | Homo sapiens | STE_TNIK_HUMAN | STE | 3e-105 | 357.1 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | TRAF2 and NCK-interacting protein kinase |
| 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 |
|---|