| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | JAK1-2 | JAK1_HUMAN | AF-P23458-K2A | P23458 | 867 | 1154 | 1154.0 | No_ligand | No_ligand | Active | DFGin | 6.307 | 13.7726 | BLAminus | -130.0, -171.31 | 51.92, 79.2 | -91.39, 17.47 | 288.09, 81.21 | -63.19, -25.32 | in-in | in | 8.0857 | Saltbr-in | 2.7191 | HRD-in | -67.76, -41.14 | 64.22, -10.98 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9399 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -50.83, 123.48 | APE9-dihe-in | -125.8, 136.55 | APE8-dihe-in | -75.77, 67.19 | APE8-rot-na | 34.45 | APE67-dihe-in | -77.12, -11.68 | -54.83, -26.9 | APE12-dist-na | 13.9103 | APE11-dist-na | 8.5318 | APE10-dist-na | 10.6595 | APE9-dist-in | 7.0627 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 288.0 | 288.0 | 0 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | AF-P23458-K2 | TYR_JAK1-2_HUMAN | TYR | 1.8e-87 | 298.9 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| TYR | JAK1-2 | JAK1_HUMAN | AF-P23458-K4A | P23458 | 867 | 1154 | 1154.0 | No_ligand | No_ligand | Active | DFGin | 6.0337 | 13.5522 | BLAminus | -127.94, -176.44 | 52.21, 91.21 | -99.55, 15.91 | 293.58, 76.0 | -63.9, -24.71 | in-in | in | 7.8098 | Saltbr-in | 2.7151 | HRD-in | -69.66, -43.24 | 62.91, -1.77 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9198 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -47.59, 114.14 | APE9-dihe-in | -120.02, 146.94 | APE8-dihe-in | -73.57, 63.93 | APE8-rot-na | 37.51 | APE67-dihe-in | -76.35, -14.96 | -54.26, -27.82 | APE12-dist-na | 13.6974 | APE11-dist-na | 8.1142 | APE10-dist-na | 10.9163 | APE9-dist-in | 6.7347 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 288.0 | 288.0 | 0 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | AF-P23458-K4 | TYR_JAK1-2_HUMAN | TYR | 1.8e-87 | 298.9 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | JAK1-2 | JAK1_HUMAN | AF-P23458-K2A | P23458 | 867 | 1154 | 1154.0 | No_ligand | No_ligand | Active | DFGin | 6.307 | 13.7726 | BLAminus | -130.0, -171.31 | 51.92, 79.2 | -91.39, 17.47 | 288.09, 81.21 | -63.19, -25.32 | in-in | in | 8.0857 | Saltbr-in | 2.7191 | HRD-in | -67.76, -41.14 | 64.22, -10.98 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9399 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -50.83, 123.48 | APE9-dihe-in | -125.8, 136.55 | APE8-dihe-in | -75.77, 67.19 | APE8-rot-na | 34.45 | APE67-dihe-in | -77.12, -11.68 | -54.83, -26.9 | APE12-dist-na | 13.9103 | APE11-dist-na | 8.5318 | APE10-dist-na | 10.6595 | APE9-dist-in | 7.0627 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 288.0 | 288.0 | 0 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | AF-P23458-K2 | Homo sapiens | TYR_JAK1-2_HUMAN | TYR | 1.8e-87 | 298.9 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| TYR | JAK1-2 | JAK1_HUMAN | AF-P23458-K4A | P23458 | 867 | 1154 | 1154.0 | No_ligand | No_ligand | Active | DFGin | 6.0337 | 13.5522 | BLAminus | -127.94, -176.44 | 52.21, 91.21 | -99.55, 15.91 | 293.58, 76.0 | -63.9, -24.71 | in-in | in | 7.8098 | Saltbr-in | 2.7151 | HRD-in | -69.66, -43.24 | 62.91, -1.77 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9198 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -47.59, 114.14 | APE9-dihe-in | -120.02, 146.94 | APE8-dihe-in | -73.57, 63.93 | APE8-rot-na | 37.51 | APE67-dihe-in | -76.35, -14.96 | -54.26, -27.82 | APE12-dist-na | 13.6974 | APE11-dist-na | 8.1142 | APE10-dist-na | 10.9163 | APE9-dist-in | 6.7347 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 288.0 | 288.0 | 0 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | AF-P23458-K4 | Homo sapiens | TYR_JAK1-2_HUMAN | TYR | 1.8e-87 | 298.9 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| 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 |
|---|