| 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 | 4E4MA | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.1804 | 13.8385 | BLAminus | -126.63, -156.25 | 24.74, 86.17 | -92.72, 21.67 | 300.1, 90.36 | -63.44, -19.58 | in-in | in | 8.4137 | Saltbr-in | 2.7781 | HRD-in | -66.9, -48.08 | 75.55, -2.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6764 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.21, 124.91 | APE9-dihe-in | -103.01, 150.72 | APE8-dihe-in | -78.71, 77.02 | APE8-rot-na | 32.56 | APE67-dihe-in | -75.65, -0.18 | -64.92, -29.56 | APE12-dist-na | 13.6695 | APE11-dist-na | 12.9145 | APE10-dist-na | 12.8148 | APE9-dist-in | 7.815 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | A | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4MB | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.3725 | 14.2034 | BLAminus | -118.84, -161.19 | 49.92, 72.51 | -97.78, 25.28 | 298.31, 88.24 | -69.84, -19.78 | in-in | in | 8.441 | Saltbr-in | 2.7441 | HRD-in | -61.1, -46.48 | 75.69, -8.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8272 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -85.14, 74.01 | APE9-dihe-in | -58.89, 145.08 | APE8-dihe-in | -79.55, 72.25 | APE8-rot-na | 32.4 | APE67-dihe-in | -77.95, -3.75 | -58.02, -29.09 | APE12-dist-na | 14.0442 | APE11-dist-na | 12.1561 | APE10-dist-na | 12.903 | APE9-dist-in | 7.9215 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | B | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4MD | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.3044 | 14.1312 | BLAminus | -117.3, -162.8 | 35.37, 82.7 | -96.62, 19.05 | 298.07, 93.7 | -70.19, -12.95 | in-in | in | 8.4961 | Saltbr-in | 3.2274 | HRD-in | -71.15, -48.12 | 79.59, -3.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7926 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -85.18, 63.68 | APE9-dihe-in | -53.04, 143.19 | APE8-dihe-in | -78.69, 70.09 | APE8-rot-na | 32.31 | APE67-dihe-in | -79.35, -2.96 | -56.35, -30.0 | APE12-dist-na | 14.2879 | APE11-dist-na | 12.1109 | APE10-dist-na | 12.7228 | APE9-dist-in | 7.8231 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | D | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4ME | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.1504 | 13.9693 | BLAminus | -129.52, -159.3 | 35.39, 81.53 | -94.01, 23.95 | 298.27, 88.38 | -61.49, -26.33 | in-in | in | 8.438 | Saltbr-in | 2.7197 | HRD-in | -66.9, -47.68 | 77.51, -1.6 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7508 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -67.74, 130.71 | APE9-dihe-in | -111.94, 154.92 | APE8-dihe-in | -81.89, 77.11 | APE8-rot-na | 32.96 | APE67-dihe-in | -74.64, -3.77 | -64.87, -30.41 | APE12-dist-na | 13.7245 | APE11-dist-na | 13.0291 | APE10-dist-na | 12.6587 | APE9-dist-in | 7.8739 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | E | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4MA | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.1804 | 13.8385 | BLAminus | -126.63, -156.25 | 24.74, 86.17 | -92.72, 21.67 | 300.1, 90.36 | -63.44, -19.58 | in-in | in | 8.4137 | Saltbr-in | 2.7781 | HRD-in | -66.9, -48.08 | 75.55, -2.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.6764 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.21, 124.91 | APE9-dihe-in | -103.01, 150.72 | APE8-dihe-in | -78.71, 77.02 | APE8-rot-na | 32.56 | APE67-dihe-in | -75.65, -0.18 | -64.92, -29.56 | APE12-dist-na | 13.6695 | APE11-dist-na | 12.9145 | APE10-dist-na | 12.8148 | APE9-dist-in | 7.815 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | A | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4MB | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.3725 | 14.2034 | BLAminus | -118.84, -161.19 | 49.92, 72.51 | -97.78, 25.28 | 298.31, 88.24 | -69.84, -19.78 | in-in | in | 8.441 | Saltbr-in | 2.7441 | HRD-in | -61.1, -46.48 | 75.69, -8.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8272 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -85.14, 74.01 | APE9-dihe-in | -58.89, 145.08 | APE8-dihe-in | -79.55, 72.25 | APE8-rot-na | 32.4 | APE67-dihe-in | -77.95, -3.75 | -58.02, -29.09 | APE12-dist-na | 14.0442 | APE11-dist-na | 12.1561 | APE10-dist-na | 12.903 | APE9-dist-in | 7.9215 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | B | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4MD | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.3044 | 14.1312 | BLAminus | -117.3, -162.8 | 35.37, 82.7 | -96.62, 19.05 | 298.07, 93.7 | -70.19, -12.95 | in-in | in | 8.4961 | Saltbr-in | 3.2274 | HRD-in | -71.15, -48.12 | 79.59, -3.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7926 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -85.18, 63.68 | APE9-dihe-in | -53.04, 143.19 | APE8-dihe-in | -78.69, 70.09 | APE8-rot-na | 32.31 | APE67-dihe-in | -79.35, -2.96 | -56.35, -30.0 | APE12-dist-na | 14.2879 | APE11-dist-na | 12.1109 | APE10-dist-na | 12.7228 | APE9-dist-in | 7.8231 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | D | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 | 4E4ME | O60674 | 835 | 1132 | 1132.0 | 0NH:1201 | Type1 | Active | DFGin | 6.1504 | 13.9693 | BLAminus | -129.52, -159.3 | 35.39, 81.53 | -94.01, 23.95 | 298.27, 88.38 | -61.49, -26.33 | in-in | in | 8.438 | Saltbr-in | 2.7197 | HRD-in | -66.9, -47.68 | 77.51, -1.6 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7508 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -67.74, 130.71 | APE9-dihe-in | -111.94, 154.92 | APE8-dihe-in | -81.89, 77.11 | APE8-rot-na | 32.96 | APE67-dihe-in | -74.64, -3.77 | -64.87, -30.41 | APE12-dist-na | 13.7245 | APE11-dist-na | 13.0291 | APE10-dist-na | 12.6587 | APE9-dist-in | 7.8739 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.25 | 0.193 | 0.25 | E | 302.0 | 298.0 | 0 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 4e4m | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 2.7e-87 | 298.3 | 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 |
|---|