| 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 | 5AX9A | Q9UKE5 | 12 | 307 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 5.2302 | 13.5497 | BLAminus | -130.68, -179.5 | 62.88, 86.0 | -93.54, 16.39 | 289.32, 99.28 | -65.74, -27.24 | in-in | in | 8.4081 | Saltbr-in | 2.5546 | HRD-in | -75.14, -52.41 | 79.64, -13.9 | 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, -97.2 | APE8-dihe-in | -70.62, 123.86 | APE8-rot-out | 63.22 | APE67-dihe-in | -60.45, -29.94 | -93.62, -15.72 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.0049 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | A | 308.0 | 282.0 | 14 | 28 | 14 | 14 | [[25, 289]] | 1.0 | 5ax9 | 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 | 5AX9B | Q9UKE5 | 13 | 307 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 5.4891 | 13.7809 | BLAminus | -131.21, 168.2 | 66.99, 91.56 | -89.13, 13.94 | 288.06, 96.49 | -49.82, -38.56 | in-in | in | 8.8832 | Saltbr-in | 2.7049 | HRD-in | -65.8, -49.95 | 70.08, 2.2 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.729 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnoi | APE10-dihe-na | 999.0, -43.89 | APE9-dihe-na | 120.72, -165.13 | APE8-dihe-in | -104.0, 119.33 | APE8-rot-in | 309.81 | APE67-dihe-in | -62.24, -16.96 | -34.16, -64.72 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.0628 | APE9-dist-in | 3.782 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | B | 308.0 | 274.0 | 21 | 28 | 16 | 12 | [[25, 289]] | 1.0 | 5ax9 | 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 | 5AX9C | Q9UKE5 | 12 | 309 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 4.8548 | 13.7471 | BLAminus | -133.31, 178.42 | 62.61, 91.57 | -88.21, 15.43 | 284.15, 96.84 | -57.06, -35.29 | in-in | in | 8.848 | Saltbr-in | 2.6267 | HRD-in | -65.76, -41.24 | 68.55, -5.67 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.939 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 149.67 | APE8-dihe-out | 50.85, 74.45 | APE8-rot-in | 323.44 | APE67-dihe-in | -64.1, -22.96 | -92.89, 2.78 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.0991 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | C | 308.0 | 282.0 | 16 | 28 | 16 | 12 | [[25, 289]] | 1.0 | 5ax9 | 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 | 5AX9A | Q9UKE5 | 12 | 307 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 5.2302 | 13.5497 | BLAminus | -130.68, -179.5 | 62.88, 86.0 | -93.54, 16.39 | 289.32, 99.28 | -65.74, -27.24 | in-in | in | 8.4081 | Saltbr-in | 2.5546 | HRD-in | -75.14, -52.41 | 79.64, -13.9 | 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, -97.2 | APE8-dihe-in | -70.62, 123.86 | APE8-rot-out | 63.22 | APE67-dihe-in | -60.45, -29.94 | -93.62, -15.72 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 10.0049 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | A | 308.0 | 282.0 | 14 | 28 | 14 | 14 | [[25, 289]] | 1.0 | 5ax9 | 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 | 5AX9B | Q9UKE5 | 13 | 307 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 5.4891 | 13.7809 | BLAminus | -131.21, 168.2 | 66.99, 91.56 | -89.13, 13.94 | 288.06, 96.49 | -49.82, -38.56 | in-in | in | 8.8832 | Saltbr-in | 2.7049 | HRD-in | -65.8, -49.95 | 70.08, 2.2 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.729 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnoi | APE10-dihe-na | 999.0, -43.89 | APE9-dihe-na | 120.72, -165.13 | APE8-dihe-in | -104.0, 119.33 | APE8-rot-in | 309.81 | APE67-dihe-in | -62.24, -16.96 | -34.16, -64.72 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.0628 | APE9-dist-in | 3.782 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | B | 308.0 | 274.0 | 21 | 28 | 16 | 12 | [[25, 289]] | 1.0 | 5ax9 | 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 | 5AX9C | Q9UKE5 | 12 | 309 | 1360.0 | 4KT:401 | Type1 | Inactive | DFGin | 4.8548 | 13.7471 | BLAminus | -133.31, 178.42 | 62.61, 91.57 | -88.21, 15.43 | 284.15, 96.84 | -57.06, -35.29 | in-in | in | 8.848 | Saltbr-in | 2.6267 | HRD-in | -65.76, -41.24 | 68.55, -5.67 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.939 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 149.67 | APE8-dihe-out | 50.85, 74.45 | APE8-rot-in | 323.44 | APE67-dihe-in | -64.1, -22.96 | -92.89, 2.78 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.0991 | None | None | None | XRAY | 2.4 | 0.208 | 0.271 | C | 308.0 | 282.0 | 16 | 28 | 16 | 12 | [[25, 289]] | 1.0 | 5ax9 | 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 |
|---|