| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWA | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Back | Inactive | DFGin | 6.6366 | 12.5628 | BLAplus | -107.37, 162.77 | 70.01, 25.25 | -77.69, -20.79 | 49.78, 78.58 | -92.33, -4.17 | out-out | out | 16.9522 | Saltbr-out | 16.8243 | HRD-in | -66.81, -58.39 | 69.73, -5.3 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.3454 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oioo | APE10-dihe-na | -136.19, -36.14 | APE9-dihe-na | -87.34, 25.43 | APE8-dihe-out | -120.09, -23.77 | APE8-rot-out | 63.21 | APE67-dihe-in | -58.2, -27.12 | -48.71, -41.35 | APE12-dist-out | 16.1855 | APE11-dist-in | 13.7792 | APE10-dist-out | 18.6507 | APE9-dist-out | 12.1535 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | A | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWD | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Back | Inactive | DFGin | 6.0387 | 12.3501 | BLAplus | -110.86, 162.98 | 67.32, 26.82 | -75.01, -16.27 | 51.63, 85.42 | -101.64, -3.07 | out-out | out | 16.407 | Saltbr-out | 12.3921 | HRD-in | -66.82, -58.27 | 73.94, -17.87 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8543 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -50.8, -49.33 | APE9-dihe-na | -74.08, 31.98 | APE8-dihe-out | -131.38, -38.39 | APE8-rot-out | 63.81 | APE67-dihe-in | -59.55, -22.6 | -47.42, -42.75 | APE12-dist-out | 17.8804 | APE11-dist-out | 14.2837 | APE10-dist-out | 19.1466 | APE9-dist-out | 11.9677 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | D | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWB | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Front | Inactive | DFGin | 6.0615 | 12.8867 | BLAplus | -112.26, 159.46 | 66.47, 30.72 | -77.06, -4.03 | 46.81, 82.8 | -112.18, 3.53 | out-out | out | 16.1976 | Saltbr-out | 14.385 | HRD-in | -68.93, -58.68 | 76.93, -11.19 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8412 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -56.67, -41.74 | APE9-dihe-na | -72.55, 0.42 | APE8-dihe-out | -131.57, -4.4 | APE8-rot-out | 77.42 | APE67-dihe-in | -62.57, -21.79 | -53.81, -31.98 | APE12-dist-out | 14.667 | APE11-dist-out | 14.0274 | APE10-dist-out | 18.4933 | APE9-dist-out | 12.4597 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | B | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWC | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Front | Inactive | DFGin | 5.6767 | 12.9838 | BLAplus | -105.78, 161.9 | 66.78, 23.82 | -68.46, -14.89 | 48.8, 88.46 | -104.69, -15.53 | out-out | out | 16.0889 | Saltbr-out | 16.0954 | HRD-in | -71.18, -58.92 | 73.09, -4.85 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.6164 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oioo | APE10-dihe-na | -67.62, -51.34 | APE9-dihe-na | -86.7, 18.29 | APE8-dihe-out | -115.5, -10.48 | APE8-rot-in | 308.5 | APE67-dihe-in | -59.14, -22.29 | -53.59, -37.71 | APE12-dist-out | 14.9863 | APE11-dist-in | 13.9487 | APE10-dist-out | 18.3728 | APE9-dist-out | 12.3026 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | C | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWA | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Back | Inactive | DFGin | 6.6366 | 12.5628 | BLAplus | -107.37, 162.77 | 70.01, 25.25 | -77.69, -20.79 | 49.78, 78.58 | -92.33, -4.17 | out-out | out | 16.9522 | Saltbr-out | 16.8243 | HRD-in | -66.81, -58.39 | 69.73, -5.3 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.3454 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oioo | APE10-dihe-na | -136.19, -36.14 | APE9-dihe-na | -87.34, 25.43 | APE8-dihe-out | -120.09, -23.77 | APE8-rot-out | 63.21 | APE67-dihe-in | -58.2, -27.12 | -48.71, -41.35 | APE12-dist-out | 16.1855 | APE11-dist-in | 13.7792 | APE10-dist-out | 18.6507 | APE9-dist-out | 12.1535 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | A | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWD | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Back | Inactive | DFGin | 6.0387 | 12.3501 | BLAplus | -110.86, 162.98 | 67.32, 26.82 | -75.01, -16.27 | 51.63, 85.42 | -101.64, -3.07 | out-out | out | 16.407 | Saltbr-out | 12.3921 | HRD-in | -66.82, -58.27 | 73.94, -17.87 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8543 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -50.8, -49.33 | APE9-dihe-na | -74.08, 31.98 | APE8-dihe-out | -131.38, -38.39 | APE8-rot-out | 63.81 | APE67-dihe-in | -59.55, -22.6 | -47.42, -42.75 | APE12-dist-out | 17.8804 | APE11-dist-out | 14.2837 | APE10-dist-out | 19.1466 | APE9-dist-out | 11.9677 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | D | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWB | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Front | Inactive | DFGin | 6.0615 | 12.8867 | BLAplus | -112.26, 159.46 | 66.47, 30.72 | -77.06, -4.03 | 46.81, 82.8 | -112.18, 3.53 | out-out | out | 16.1976 | Saltbr-out | 14.385 | HRD-in | -68.93, -58.68 | 76.93, -11.19 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8412 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -56.67, -41.74 | APE9-dihe-na | -72.55, 0.42 | APE8-dihe-out | -131.57, -4.4 | APE8-rot-out | 77.42 | APE67-dihe-in | -62.57, -21.79 | -53.81, -31.98 | APE12-dist-out | 14.667 | APE11-dist-out | 14.0274 | APE10-dist-out | 18.4933 | APE9-dist-out | 12.4597 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | B | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| TKL | MAP3K20 | M3K20_HUMAN | 7YAWC | Q9NYL2 | 8 | 299 | 800.0 | IGS:60401 | Type1.5_Front | Inactive | DFGin | 5.6767 | 12.9838 | BLAplus | -105.78, 161.9 | 66.78, 23.82 | -68.46, -14.89 | 48.8, 88.46 | -104.69, -15.53 | out-out | out | 16.0889 | Saltbr-out | 16.0954 | HRD-in | -71.18, -58.92 | 73.09, -4.85 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.6164 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oioo | APE10-dihe-na | -67.62, -51.34 | APE9-dihe-na | -86.7, 18.29 | APE8-dihe-out | -115.5, -10.48 | APE8-rot-in | 308.5 | APE67-dihe-in | -59.14, -22.29 | -53.59, -37.71 | APE12-dist-out | 14.9863 | APE11-dist-in | 13.9487 | APE10-dist-out | 18.3728 | APE9-dist-out | 12.3026 | None | None | None | XRAY | 2.1 | 0.208 | 0.243 | C | 310.0 | 291.0 | 1 | 26 | 25 | 1 | [[16, 262]] | 1.0 | 7yaw | Homo sapiens | TKL_MAP3K20_HUMAN | TKL | 1.2e-78 | 270.4 | 2.0 | 266.0 | 265.0 | 150 | 151 | 152 | 154 | 156 | 45 | 53 | 57 | 130 | 132 | 131 | 133.0 | 188 | 176 | 171 | 170 | 169 | 168 | 167 | 166 | 165 | 83 | Mitogen-activated protein kinase kinase kinase 20 |
| 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 |
|---|