| 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 | 5CF4A | O60674 | 843 | 1131 | 1132.0 | 50Y:4000 | Type1 | Inactive | DFGin | 6.2954 | 13.5795 | ABAminus | -103.56, 3.37 | -156.43, 145.58 | -135.49, 36.18 | 298.36, 87.67 | -61.24, -32.94 | in-in | in | 8.4712 | Saltbr-in | 2.725 | HRD-in | -60.77, -47.53 | 65.86, 5.68 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7533 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -76.53, 110.94 | APE9-dihe-in | -84.82, 139.81 | APE8-dihe-in | -78.84, 67.91 | APE8-rot-na | 30.09 | APE67-dihe-in | -80.84, 0.88 | -52.35, -28.91 | APE12-dist-na | 13.0139 | APE11-dist-na | 12.1711 | APE10-dist-na | 13.1906 | APE9-dist-in | 7.8124 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.38 | 0.252 | 0.253 | A | 321.0 | 285.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 5cf4 | TYR_JAK2-2_HUMAN | TYR | 3.4e-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 | 5CF4B | O60674 | 839 | 1132 | 1132.0 | 50Y:4000 | Type1 | Inactive | DFGin | 6.3567 | 13.6094 | ABAminus | -103.87, 5.06 | -157.73, 143.99 | -135.02, 36.0 | 298.42, 86.53 | -61.5, -31.7 | in-in | in | 8.4493 | Saltbr-in | 2.768 | HRD-in | -62.02, -51.24 | 72.04, 5.25 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7562 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | 49.02, 84.4 | APE9-dihe-in | -103.49, 134.66 | APE8-dihe-in | -78.95, 68.18 | APE8-rot-na | 29.68 | APE67-dihe-in | -80.17, 0.94 | -52.54, -29.08 | APE12-dist-na | 12.8725 | APE11-dist-na | 11.4027 | APE10-dist-na | 11.8543 | APE9-dist-in | 7.8674 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.38 | 0.252 | 0.253 | B | 321.0 | 293.0 | 1 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 5cf4 | TYR_JAK2-2_HUMAN | TYR | 3.4e-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 | 5CF4A | O60674 | 843 | 1131 | 1132.0 | 50Y:4000 | Type1 | Inactive | DFGin | 6.2954 | 13.5795 | ABAminus | -103.56, 3.37 | -156.43, 145.58 | -135.49, 36.18 | 298.36, 87.67 | -61.24, -32.94 | in-in | in | 8.4712 | Saltbr-in | 2.725 | HRD-in | -60.77, -47.53 | 65.86, 5.68 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7533 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -76.53, 110.94 | APE9-dihe-in | -84.82, 139.81 | APE8-dihe-in | -78.84, 67.91 | APE8-rot-na | 30.09 | APE67-dihe-in | -80.84, 0.88 | -52.35, -28.91 | APE12-dist-na | 13.0139 | APE11-dist-na | 12.1711 | APE10-dist-na | 13.1906 | APE9-dist-in | 7.8124 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.38 | 0.252 | 0.253 | A | 321.0 | 285.0 | 4 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 5cf4 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 3.4e-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 | 5CF4B | O60674 | 839 | 1132 | 1132.0 | 50Y:4000 | Type1 | Inactive | DFGin | 6.3567 | 13.6094 | ABAminus | -103.87, 5.06 | -157.73, 143.99 | -135.02, 36.0 | 298.42, 86.53 | -61.5, -31.7 | in-in | in | 8.4493 | Saltbr-in | 2.768 | HRD-in | -62.02, -51.24 | 72.04, 5.25 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7562 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | 49.02, 84.4 | APE9-dihe-in | -103.49, 134.66 | APE8-dihe-in | -78.95, 68.18 | APE8-rot-na | 29.68 | APE67-dihe-in | -80.17, 0.94 | -52.54, -29.08 | APE12-dist-na | 12.8725 | APE11-dist-na | 11.4027 | APE10-dist-na | 11.8543 | APE9-dist-in | 7.8674 | None | PTR1007,PTR1008 | PTR1007,PTR1008 | XRAY | 2.38 | 0.252 | 0.253 | B | 321.0 | 293.0 | 1 | 31 | 31 | 0 | [[545, 807], [849, 1125]] | 2.0 | 5cf4 | Homo sapiens | TYR_JAK2-2_HUMAN | TYR | 3.4e-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 |
|---|