| 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 | MAP3K11 | M3K11_HUMAN | AF-Q16584-K1A | Q16584 | 109 | 386 | 847.0 | No_ligand | No_ligand | Active | DFGin | 6.564 | 13.4124 | BLAminus | -138.83, -178.96 | 62.69, 67.5 | -83.29, 11.29 | 297.78, 106.2 | -59.64, -32.67 | in-in | in | 8.4574 | Saltbr-in | 2.7771 | HRD-in | -76.66, -41.96 | 67.28, 1.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9744 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.46, 152.67 | APE9-dihe-na | 109.93, -176.43 | APE8-dihe-in | -95.26, 120.77 | APE8-rot-in | 300.83 | APE67-dihe-in | -65.58, -17.25 | -48.11, -39.44 | APE12-dist-in | 9.5929 | APE11-dist-in | 11.5553 | APE10-dist-in | 5.9618 | APE9-dist-in | 4.0732 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 278.0 | 278.0 | 0 | 26 | 26 | 0 | [[116, 378]] | 1.0 | AF-Q16584-K1 | TKL_MAP3K11_HUMAN | TKL | 3e-88 | 301.7 | 2.0 | 266.0 | 265.0 | 266 | 267 | 268 | 270 | 272 | 144 | 164 | 168 | 238 | 240 | 239 | 241.0 | 304 | 292 | 287 | 286 | 285 | 284 | 283 | 282 | 281 | 194 | Mitogen-activated protein kinase kinase kinase 11 |
| TKL | MAP3K11 | M3K11_HUMAN | AF-Q16584-K3A | Q16584 | 109 | 386 | 847.0 | No_ligand | No_ligand | Active | DFGin | 6.8199 | 13.9469 | BLAminus | -138.27, -179.8 | 62.1, 69.28 | -85.5, 10.32 | 290.1, 79.1 | -58.81, -29.72 | in-in | in | 8.6033 | Saltbr-in | 2.7211 | HRD-in | -80.67, -43.46 | 69.15, -7.94 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9368 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -149.13, 149.56 | APE9-dihe-na | 113.01, -165.25 | APE8-dihe-in | -107.97, 119.33 | APE8-rot-in | 315.34 | APE67-dihe-in | -65.67, -18.57 | -52.08, -36.28 | APE12-dist-in | 9.6229 | APE11-dist-in | 11.5579 | APE10-dist-in | 5.9411 | APE9-dist-in | 3.8658 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 278.0 | 278.0 | 0 | 26 | 26 | 0 | [[116, 378]] | 1.0 | AF-Q16584-K3 | TKL_MAP3K11_HUMAN | TKL | 3e-88 | 301.7 | 2.0 | 266.0 | 265.0 | 266 | 267 | 268 | 270 | 272 | 144 | 164 | 168 | 238 | 240 | 239 | 241.0 | 304 | 292 | 287 | 286 | 285 | 284 | 283 | 282 | 281 | 194 | Mitogen-activated protein kinase kinase kinase 11 |
| 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 | MAP3K11 | M3K11_HUMAN | AF-Q16584-K1A | Q16584 | 109 | 386 | 847.0 | No_ligand | No_ligand | Active | DFGin | 6.564 | 13.4124 | BLAminus | -138.83, -178.96 | 62.69, 67.5 | -83.29, 11.29 | 297.78, 106.2 | -59.64, -32.67 | in-in | in | 8.4574 | Saltbr-in | 2.7771 | HRD-in | -76.66, -41.96 | 67.28, 1.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9744 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.46, 152.67 | APE9-dihe-na | 109.93, -176.43 | APE8-dihe-in | -95.26, 120.77 | APE8-rot-in | 300.83 | APE67-dihe-in | -65.58, -17.25 | -48.11, -39.44 | APE12-dist-in | 9.5929 | APE11-dist-in | 11.5553 | APE10-dist-in | 5.9618 | APE9-dist-in | 4.0732 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 278.0 | 278.0 | 0 | 26 | 26 | 0 | [[116, 378]] | 1.0 | AF-Q16584-K1 | Homo sapiens | TKL_MAP3K11_HUMAN | TKL | 3e-88 | 301.7 | 2.0 | 266.0 | 265.0 | 266 | 267 | 268 | 270 | 272 | 144 | 164 | 168 | 238 | 240 | 239 | 241.0 | 304 | 292 | 287 | 286 | 285 | 284 | 283 | 282 | 281 | 194 | Mitogen-activated protein kinase kinase kinase 11 |
| TKL | MAP3K11 | M3K11_HUMAN | AF-Q16584-K3A | Q16584 | 109 | 386 | 847.0 | No_ligand | No_ligand | Active | DFGin | 6.8199 | 13.9469 | BLAminus | -138.27, -179.8 | 62.1, 69.28 | -85.5, 10.32 | 290.1, 79.1 | -58.81, -29.72 | in-in | in | 8.6033 | Saltbr-in | 2.7211 | HRD-in | -80.67, -43.46 | 69.15, -7.94 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9368 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -149.13, 149.56 | APE9-dihe-na | 113.01, -165.25 | APE8-dihe-in | -107.97, 119.33 | APE8-rot-in | 315.34 | APE67-dihe-in | -65.67, -18.57 | -52.08, -36.28 | APE12-dist-in | 9.6229 | APE11-dist-in | 11.5579 | APE10-dist-in | 5.9411 | APE9-dist-in | 3.8658 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 278.0 | 278.0 | 0 | 26 | 26 | 0 | [[116, 378]] | 1.0 | AF-Q16584-K3 | Homo sapiens | TKL_MAP3K11_HUMAN | TKL | 3e-88 | 301.7 | 2.0 | 266.0 | 265.0 | 266 | 267 | 268 | 270 | 272 | 144 | 164 | 168 | 238 | 240 | 239 | 241.0 | 304 | 292 | 287 | 286 | 285 | 284 | 283 | 282 | 281 | 194 | Mitogen-activated protein kinase kinase kinase 11 |
| 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 |
|---|