| 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 | 2W1IB | O60674 | 843 | 1132 | 1132.0 | No_ligand | No_ligand | Inactive | DFGin | 5.9971 | 13.8453 | BLAminus | -129.87, -167.39 | 53.3, 77.87 | -90.81, 22.6 | 298.76, 93.77 | -65.07, -29.79 | in-out | in | 8.4285 | Saltbr-out | 3.8488 | HRD-in | -57.34, -41.14 | 62.34, 9.12 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.7209 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -53.98, 136.0 | APE9-dihe-in | -141.41, 130.69 | APE8-dihe-in | -74.31, 69.47 | APE8-rot-na | 31.54 | APE67-dihe-in | -71.28, -6.63 | -56.8, -34.08 | APE12-dist-na | 10.4807 | APE11-dist-na | 9.4804 | APE10-dist-na | 10.2514 | APE9-dist-in | 6.7862 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.6 | 0.209 | 0.295 | B | 326.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 2w1i | TYR_JAK2-2_HUMAN | TYR | 3.6e-87 | 298.0 | 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 | 2W1IA | O60674 | 843 | 1132 | 1132.0 | L0I:2133 | Type1 | Active | DFGin | 6.0925 | 14.0902 | BLAminus | -142.48, -169.83 | 51.96, 80.95 | -93.55, 29.52 | 297.23, 91.38 | -67.11, -31.24 | in-in | in | 8.3967 | Saltbr-in | 3.0634 | HRD-in | -62.15, -46.21 | 66.4, 9.56 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6778 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -58.29, 137.22 | APE9-dihe-in | -138.71, 128.52 | APE8-dihe-in | -70.92, 67.85 | APE8-rot-na | 29.05 | APE67-dihe-in | -68.18, -7.39 | -56.23, -38.03 | APE12-dist-na | 10.6088 | APE11-dist-na | 9.4047 | APE10-dist-na | 10.3336 | APE9-dist-in | 6.8851 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.6 | 0.209 | 0.295 | A | 326.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 2w1i | TYR_JAK2-2_HUMAN | TYR | 3.6e-87 | 298.0 | 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 | 2W1IB | O60674 | 843 | 1132 | 1132.0 | No_ligand | No_ligand | Inactive | DFGin | 5.9971 | 13.8453 | BLAminus | -129.87, -167.39 | 53.3, 77.87 | -90.81, 22.6 | 298.76, 93.77 | -65.07, -29.79 | in-out | in | 8.4285 | Saltbr-out | 3.8488 | HRD-in | -57.34, -41.14 | 62.34, 9.12 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.7209 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -53.98, 136.0 | APE9-dihe-in | -141.41, 130.69 | APE8-dihe-in | -74.31, 69.47 | APE8-rot-na | 31.54 | APE67-dihe-in | -71.28, -6.63 | -56.8, -34.08 | APE12-dist-na | 10.4807 | APE11-dist-na | 9.4804 | APE10-dist-na | 10.2514 | APE9-dist-in | 6.7862 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.6 | 0.209 | 0.295 | B | 326.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 2w1i | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 3.6e-87 | 298.0 | 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 | 2W1IA | O60674 | 843 | 1132 | 1132.0 | L0I:2133 | Type1 | Active | DFGin | 6.0925 | 14.0902 | BLAminus | -142.48, -169.83 | 51.96, 80.95 | -93.55, 29.52 | 297.23, 91.38 | -67.11, -31.24 | in-in | in | 8.3967 | Saltbr-in | 3.0634 | HRD-in | -62.15, -46.21 | 66.4, 9.56 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6778 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -58.29, 137.22 | APE9-dihe-in | -138.71, 128.52 | APE8-dihe-in | -70.92, 67.85 | APE8-rot-na | 29.05 | APE67-dihe-in | -68.18, -7.39 | -56.23, -38.03 | APE12-dist-na | 10.6088 | APE11-dist-na | 9.4047 | APE10-dist-na | 10.3336 | APE9-dist-in | 6.8851 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.6 | 0.209 | 0.295 | A | 326.0 | 286.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 2w1i | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 3.6e-87 | 298.0 | 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 |
|---|