| 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 | 6VS3A | O60674 | 843 | 1131 | 1132.0 | R6V:61201 | Type1 | Inactive | DFGin | 6.1717 | 13.4003 | ABAminus | -113.69, -9.73 | -145.44, 139.92 | -129.95, 28.79 | 298.53, 82.06 | -63.1, -23.05 | in-in | in | 8.6277 | Saltbr-in | 2.6649 | HRD-in | -70.46, -47.53 | 70.83, 1.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7159 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -96.96, 143.74 | APE9-dihe-in | -124.34, 136.67 | APE8-dihe-in | -71.53, 71.61 | APE8-rot-na | 30.56 | APE67-dihe-in | -80.97, -2.5 | -64.33, -23.02 | APE12-dist-na | 13.5335 | APE11-dist-na | 12.1921 | APE10-dist-na | 12.9551 | APE9-dist-in | 7.7308 | None | PTR1007 | PTR1007 | XRAY | 2.0 | 0.186 | 0.218 | A | 308.0 | 289.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 6vs3 | TYR_JAK2-2_HUMAN | TYR | 2.9e-87 | 298.2 | 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 | 6VS3B | O60674 | 840 | 1132 | 1132.0 | R6V:61201 | Type1 | Inactive | DFGin | 6.4479 | 13.6512 | ABAminus | -115.02, -9.81 | -144.91, 138.32 | -130.18, 30.61 | 296.48, 83.03 | -64.54, -21.19 | in-in | in | 8.5909 | Saltbr-in | 2.7581 | HRD-in | -72.75, -48.7 | 73.41, 1.11 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7917 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -102.71, 137.37 | APE9-dihe-in | -128.13, 115.26 | APE8-dihe-in | -80.11, 76.19 | APE8-rot-na | 29.15 | APE67-dihe-in | -81.55, -1.54 | -62.24, -25.56 | APE12-dist-na | 13.4815 | APE11-dist-na | 9.5694 | APE10-dist-na | 8.8432 | APE9-dist-in | 6.8155 | None | PTR1007 | PTR1007 | XRAY | 2.0 | 0.186 | 0.218 | B | 308.0 | 293.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 6vs3 | TYR_JAK2-2_HUMAN | TYR | 2.9e-87 | 298.2 | 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 | 6VS3A | O60674 | 843 | 1131 | 1132.0 | R6V:61201 | Type1 | Inactive | DFGin | 6.1717 | 13.4003 | ABAminus | -113.69, -9.73 | -145.44, 139.92 | -129.95, 28.79 | 298.53, 82.06 | -63.1, -23.05 | in-in | in | 8.6277 | Saltbr-in | 2.6649 | HRD-in | -70.46, -47.53 | 70.83, 1.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7159 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -96.96, 143.74 | APE9-dihe-in | -124.34, 136.67 | APE8-dihe-in | -71.53, 71.61 | APE8-rot-na | 30.56 | APE67-dihe-in | -80.97, -2.5 | -64.33, -23.02 | APE12-dist-na | 13.5335 | APE11-dist-na | 12.1921 | APE10-dist-na | 12.9551 | APE9-dist-in | 7.7308 | None | PTR1007 | PTR1007 | XRAY | 2.0 | 0.186 | 0.218 | A | 308.0 | 289.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 6vs3 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.9e-87 | 298.2 | 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 | 6VS3B | O60674 | 840 | 1132 | 1132.0 | R6V:61201 | Type1 | Inactive | DFGin | 6.4479 | 13.6512 | ABAminus | -115.02, -9.81 | -144.91, 138.32 | -130.18, 30.61 | 296.48, 83.03 | -64.54, -21.19 | in-in | in | 8.5909 | Saltbr-in | 2.7581 | HRD-in | -72.75, -48.7 | 73.41, 1.11 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7917 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -102.71, 137.37 | APE9-dihe-in | -128.13, 115.26 | APE8-dihe-in | -80.11, 76.19 | APE8-rot-na | 29.15 | APE67-dihe-in | -81.55, -1.54 | -62.24, -25.56 | APE12-dist-na | 13.4815 | APE11-dist-na | 9.5694 | APE10-dist-na | 8.8432 | APE9-dist-in | 6.8155 | None | PTR1007 | PTR1007 | XRAY | 2.0 | 0.186 | 0.218 | B | 308.0 | 293.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 6vs3 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.9e-87 | 298.2 | 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 |
|---|