| 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 | JAK2-2 | JAK2_HUMAN | 7UYWA | O60674 | 842 | 1131 | 1132.0 | OV0:1201 | Type1 | Inactive | DFGin | 6.162 | 13.552 | ABAminus | -102.13, -65.77 | -97.61, 118.73 | -112.34, 34.06 | 302.3, 86.62 | -68.86, -35.74 | in-in | in | 8.446 | Saltbr-in | 3.127 | HRD-in | -63.99, -43.03 | 64.14, 10.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.857 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -67.32, 131.93 | APE9-dihe-in | -128.43, 132.61 | APE8-dihe-in | -78.21, 78.3 | APE8-rot-na | 32.14 | APE67-dihe-in | -77.48, -5.27 | -63.06, -29.41 | APE12-dist-na | 10.281 | APE11-dist-na | 9.748 | APE10-dist-na | 10.244 | APE9-dist-in | 6.83 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.51 | 0.21 | 0.26 | A | 291 | 290 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 7uyw | TYR_JAK2-2_HUMAN | TYR | 2.3e-87 | 298.5 | 1 | 260 | 260 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| TYR | TYK2-2 | TYK2_HUMAN | 7UYUA | P29597 | 889 | 1177 | 1187.0 | OV0:1201 | Type1 | None | DFGin | 6.732 | 13.693 | BLAminus | -116.0, -173.86 | 46.69, 88.81 | -102.3, 31.38 | 294.59, 76.31 | -71.39, -32.91 | in-in | in | 7.837 | Saltbr-in | 3.038 | HRD-in | -86.52, -53.34 | 77.94, 2.86 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.911 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 117.29 | APE8-dihe-in | -82.32, 79.72 | APE8-rot-na | 31.91 | APE67-dihe-in | -72.66, -7.56 | -62.66, -28.85 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 6.58 | None | PTR1054,PTR1055 | PTR1054,PTR1055 | XRAY | 2.05 | 0.227 | 0.257 | A | 289 | 269 | 20 | 31 | 24 | 7 | [[589, 868], [897, 1171]] | 2.0 | 7uyu | TYR_TYK2-2_HUMAN | TYR | 1.1e-81 | 279.9 | 2 | 260 | 259 | 1040 | 1041 | 1042 | 1044 | 1046 | 930 | 947 | 951 | 1020 | 1022 | 1021 | 1023 | 1083 | 1071 | 1066 | 1065 | 1064 | 1063 | 1062 | 1061 | 1060 | 979 | Non-receptor tyrosine-protein kinase TYK2 |
| 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 | JAK2-2 | JAK2_HUMAN | 7UYWA | O60674 | 842 | 1131 | 1132.0 | OV0:1201 | Type1 | Inactive | DFGin | 6.162 | 13.552 | ABAminus | -102.13, -65.77 | -97.61, 118.73 | -112.34, 34.06 | 302.3, 86.62 | -68.86, -35.74 | in-in | in | 8.446 | Saltbr-in | 3.127 | HRD-in | -63.99, -43.03 | 64.14, 10.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.857 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -67.32, 131.93 | APE9-dihe-in | -128.43, 132.61 | APE8-dihe-in | -78.21, 78.3 | APE8-rot-na | 32.14 | APE67-dihe-in | -77.48, -5.27 | -63.06, -29.41 | APE12-dist-na | 10.281 | APE11-dist-na | 9.748 | APE10-dist-na | 10.244 | APE9-dist-in | 6.83 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.51 | 0.21 | 0.26 | A | 291 | 290 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 7uyw | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.3e-87 | 298.5 | 1 | 260 | 260 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| TYR | TYK2-2 | TYK2_HUMAN | 7UYUA | P29597 | 889 | 1177 | 1187.0 | OV0:1201 | Type1 | None | DFGin | 6.732 | 13.693 | BLAminus | -116.0, -173.86 | 46.69, 88.81 | -102.3, 31.38 | 294.59, 76.31 | -71.39, -32.91 | in-in | in | 7.837 | Saltbr-in | 3.038 | HRD-in | -86.52, -53.34 | 77.94, 2.86 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.911 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 117.29 | APE8-dihe-in | -82.32, 79.72 | APE8-rot-na | 31.91 | APE67-dihe-in | -72.66, -7.56 | -62.66, -28.85 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 6.58 | None | PTR1054,PTR1055 | PTR1054,PTR1055 | XRAY | 2.05 | 0.227 | 0.257 | A | 289 | 269 | 20 | 31 | 24 | 7 | [[589, 868], [897, 1171]] | 2.0 | 7uyu | Homo sapiens | TYR_TYK2-2_HUMAN | TYR | 1.1e-81 | 279.9 | 2 | 260 | 259 | 1040 | 1041 | 1042 | 1044 | 1046 | 930 | 947 | 951 | 1020 | 1022 | 1021 | 1023 | 1083 | 1071 | 1066 | 1065 | 1064 | 1063 | 1062 | 1061 | 1060 | 979 | Non-receptor tyrosine-protein kinase TYK2 |
| 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 |
|---|