| 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 | 4JI9A | O60674 | 843 | 1132 | 1132.0 | 1M3:1201 | Type1 | Inactive | DFGin | 6.3239 | 13.4839 | ABAminus | -109.55, -7.44 | -150.82, 140.52 | -127.26, 30.44 | 299.13, 87.76 | -52.84, -40.14 | in-in | in | 8.585 | Saltbr-in | 2.6472 | HRD-in | -80.17, -42.61 | 76.43, -32.58 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7518 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -82.23, 111.22 | APE9-dihe-in | -100.97, 137.91 | APE8-dihe-in | -72.06, 68.6 | APE8-rot-na | 27.55 | APE67-dihe-in | -77.94, 0.46 | -63.88, -26.22 | APE12-dist-na | 13.4406 | APE11-dist-na | 13.3171 | APE10-dist-na | 13.3201 | APE9-dist-out | 8.7568 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.4 | 0.203 | 0.245 | A | 300.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4ji9 | TYR_JAK2-2_HUMAN | TYR | 2.6e-87 | 298.4 | 1.0 | 260.0 | 260.0 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976.0 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| TYR | JAK2-2 | JAK2_HUMAN | 4JI9B | O60674 | 839 | 1132 | 1132.0 | 1M3:1201 | Type1 | Inactive | DFGin | 6.466 | 13.8486 | ABAminus | -116.52, -6.78 | -147.24, 138.79 | -124.56, 33.92 | 292.32, 86.1 | -62.37, -34.07 | in-in | in | 8.4907 | Saltbr-in | 2.8224 | HRD-in | -81.25, -47.33 | 75.7, -23.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6971 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.22, 150.08 | APE9-dihe-in | -122.92, 128.48 | APE8-dihe-in | -79.58, 77.7 | APE8-rot-na | 25.7 | APE67-dihe-in | -82.32, 3.2 | -61.18, -27.11 | APE12-dist-na | 8.057 | APE11-dist-na | 10.4553 | APE10-dist-na | 11.075 | APE9-dist-in | 7.6984 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.4 | 0.203 | 0.245 | B | 300.0 | 290.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4ji9 | TYR_JAK2-2_HUMAN | TYR | 2.6e-87 | 298.4 | 1.0 | 260.0 | 260.0 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976.0 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| 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 | 4JI9A | O60674 | 843 | 1132 | 1132.0 | 1M3:1201 | Type1 | Inactive | DFGin | 6.3239 | 13.4839 | ABAminus | -109.55, -7.44 | -150.82, 140.52 | -127.26, 30.44 | 299.13, 87.76 | -52.84, -40.14 | in-in | in | 8.585 | Saltbr-in | 2.6472 | HRD-in | -80.17, -42.61 | 76.43, -32.58 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7518 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -82.23, 111.22 | APE9-dihe-in | -100.97, 137.91 | APE8-dihe-in | -72.06, 68.6 | APE8-rot-na | 27.55 | APE67-dihe-in | -77.94, 0.46 | -63.88, -26.22 | APE12-dist-na | 13.4406 | APE11-dist-na | 13.3171 | APE10-dist-na | 13.3201 | APE9-dist-out | 8.7568 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.4 | 0.203 | 0.245 | A | 300.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4ji9 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.6e-87 | 298.4 | 1.0 | 260.0 | 260.0 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976.0 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| TYR | JAK2-2 | JAK2_HUMAN | 4JI9B | O60674 | 839 | 1132 | 1132.0 | 1M3:1201 | Type1 | Inactive | DFGin | 6.466 | 13.8486 | ABAminus | -116.52, -6.78 | -147.24, 138.79 | -124.56, 33.92 | 292.32, 86.1 | -62.37, -34.07 | in-in | in | 8.4907 | Saltbr-in | 2.8224 | HRD-in | -81.25, -47.33 | 75.7, -23.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6971 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.22, 150.08 | APE9-dihe-in | -122.92, 128.48 | APE8-dihe-in | -79.58, 77.7 | APE8-rot-na | 25.7 | APE67-dihe-in | -82.32, 3.2 | -61.18, -27.11 | APE12-dist-na | 8.057 | APE11-dist-na | 10.4553 | APE10-dist-na | 11.075 | APE9-dist-in | 7.6984 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.4 | 0.203 | 0.245 | B | 300.0 | 290.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4ji9 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.6e-87 | 298.4 | 1.0 | 260.0 | 260.0 | 993 | 994 | 995 | 997 | 999 | 882 | 898 | 902 | 973 | 975 | 974 | 976.0 | 1036 | 1024 | 1019 | 1018 | 1017 | 1016 | 1015 | 1014 | 1013 | 930 | Tyrosine-protein kinase JAK2 |
| 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 |
|---|