| 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 | ILK | ILK_HUMAN | 3KMUA | Q13418 | 185 | 451 | 452.0 | No_ligand | No_ligand | Pseudo | DFGinter | 8.1149 | 7.0232 | None | -89.09, 107.07 | -68.14, -22.77 | -71.11, -14.21 | 999.0, 999.0 | -91.44, 11.74 | out-out | out | 13.6946 | Saltbr-out | 11.0118 | HRD-out | 62.49, 27.89 | -91.99, 115.71 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.5973 | ActLoopCT-out | nonTYR | APEdihe_aaini | APEdist_oooo | APE10-dihe-na | -104.26, 122.36 | APE9-dihe-na | -103.82, -5.41 | APE8-dihe-in | -135.57, 56.37 | APE8-rot-none | 999.0 | APE67-dihe-in | -59.41, -24.29 | -65.19, -22.44 | APE12-dist-out | 15.0455 | APE11-dist-out | 14.1318 | APE10-dist-out | 12.9993 | APE9-dist-out | 12.9702 | C346S,C422S | None | MSE272,MSE301,MSE305,MSE326,MSE331,MSE337,MSE350,MSE375,MSE398,MSE402,MSE425,MSE429,MSE441,MSE449 | XRAY | 1.8 | 0.202 | 0.236 | A | 271.0 | 267.0 | 0 | 23 | 23 | 0 | [[192, 448]] | 1.0 | 3kmu | TKL_ILK_HUMAN | TKL | 1.5e-62 | 217.5 | 3.0 | 267.0 | 265.0 | 336 | 337 | 338 | 340 | 342 | 220 | 238 | 242 | 316 | 318 | 317 | 319.0 | 374 | 359 | 354 | 353 | 352 | 351 | 350 | 349 | 348 | 270 | Scaffold protein ILK |
| 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 | ILK | ILK_HUMAN | 3KMUA | Q13418 | 185 | 451 | 452.0 | No_ligand | No_ligand | Pseudo | DFGinter | 8.1149 | 7.0232 | None | -89.09, 107.07 | -68.14, -22.77 | -71.11, -14.21 | 999.0, 999.0 | -91.44, 11.74 | out-out | out | 13.6946 | Saltbr-out | 11.0118 | HRD-out | 62.49, 27.89 | -91.99, 115.71 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.5973 | ActLoopCT-out | nonTYR | APEdihe_aaini | APEdist_oooo | APE10-dihe-na | -104.26, 122.36 | APE9-dihe-na | -103.82, -5.41 | APE8-dihe-in | -135.57, 56.37 | APE8-rot-none | 999.0 | APE67-dihe-in | -59.41, -24.29 | -65.19, -22.44 | APE12-dist-out | 15.0455 | APE11-dist-out | 14.1318 | APE10-dist-out | 12.9993 | APE9-dist-out | 12.9702 | C346S,C422S | None | MSE272,MSE301,MSE305,MSE326,MSE331,MSE337,MSE350,MSE375,MSE398,MSE402,MSE425,MSE429,MSE441,MSE449 | XRAY | 1.8 | 0.202 | 0.236 | A | 271.0 | 267.0 | 0 | 23 | 23 | 0 | [[192, 448]] | 1.0 | 3kmu | Homo sapiens | TKL_ILK_HUMAN | TKL | 1.5e-62 | 217.5 | 3.0 | 267.0 | 265.0 | 336 | 337 | 338 | 340 | 342 | 220 | 238 | 242 | 316 | 318 | 317 | 319.0 | 374 | 359 | 354 | 353 | 352 | 351 | 350 | 349 | 348 | 270 | Scaffold protein ILK |
| 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 |
|---|