| 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 | JAK3-2 | JAK3_HUMAN | 7APFA | P52333 | 814 | 1103 | 1124.0 | RQZ:1201 | Type1 | Inactive | DFGin | 6.1423 | 14.108 | BLAminus | -125.02, -164.76 | 52.74, 82.07 | -99.72, 24.14 | 279.87, 69.9 | -58.8, -33.19 | in-in | in | 8.0164 | Saltbr-in | 2.735 | HRD-in | -77.19, -45.73 | 75.08, -49.11 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8014 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -141.26, 128.28 | APE9-dihe-in | -143.67, 157.99 | APE8-dihe-in | -81.92, 93.49 | APE8-rot-na | 7.76 | APE67-dihe-in | -79.55, -5.28 | -69.3, -23.78 | APE12-dist-na | 10.1511 | APE11-dist-na | 13.6863 | APE10-dist-na | 13.2698 | APE9-dist-out | 9.0224 | None | None | None | XRAY | 1.95 | 0.206 | 0.255 | A | 294.0 | 290.0 | 0 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 7apf | TYR_JAK3-2_HUMAN | TYR | 4e-80 | 274.8 | 1.0 | 260.0 | 260.0 | 966 | 967 | 968 | 970 | 972 | 855 | 871 | 875 | 946 | 948 | 947 | 949.0 | 1009 | 997 | 992 | 991 | 990 | 989 | 988 | 987 | 986 | 903 | Tyrosine-protein kinase JAK3 |
| TYR | JAK3-2 | JAK3_HUMAN | 7APFB | P52333 | 814 | 1103 | 1124.0 | RQZ:1201 | Type1 | Inactive | DFGin | 6.2636 | 13.9552 | BLAminus | -125.48, -163.38 | 48.35, 84.73 | -99.0, 25.48 | 280.41, 70.13 | -63.69, -28.85 | in-in | in | 8.0989 | Saltbr-in | 2.7319 | HRD-in | -80.63, -44.7 | 74.93, -48.31 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7771 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -141.78, 126.08 | APE9-dihe-in | -146.46, 155.19 | APE8-dihe-in | -90.31, 98.72 | APE8-rot-na | 9.96 | APE67-dihe-in | -78.0, -2.22 | -75.31, -23.81 | APE12-dist-na | 9.6188 | APE11-dist-na | 13.0285 | APE10-dist-na | 12.5423 | APE9-dist-out | 9.1313 | None | None | None | XRAY | 1.95 | 0.206 | 0.255 | B | 294.0 | 285.0 | 5 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 7apf | TYR_JAK3-2_HUMAN | TYR | 4e-80 | 274.8 | 1.0 | 260.0 | 260.0 | 966 | 967 | 968 | 970 | 972 | 855 | 871 | 875 | 946 | 948 | 947 | 949.0 | 1009 | 997 | 992 | 991 | 990 | 989 | 988 | 987 | 986 | 903 | Tyrosine-protein kinase JAK3 |
| 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 | JAK3-2 | JAK3_HUMAN | 7APFA | P52333 | 814 | 1103 | 1124.0 | RQZ:1201 | Type1 | Inactive | DFGin | 6.1423 | 14.108 | BLAminus | -125.02, -164.76 | 52.74, 82.07 | -99.72, 24.14 | 279.87, 69.9 | -58.8, -33.19 | in-in | in | 8.0164 | Saltbr-in | 2.735 | HRD-in | -77.19, -45.73 | 75.08, -49.11 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8014 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -141.26, 128.28 | APE9-dihe-in | -143.67, 157.99 | APE8-dihe-in | -81.92, 93.49 | APE8-rot-na | 7.76 | APE67-dihe-in | -79.55, -5.28 | -69.3, -23.78 | APE12-dist-na | 10.1511 | APE11-dist-na | 13.6863 | APE10-dist-na | 13.2698 | APE9-dist-out | 9.0224 | None | None | None | XRAY | 1.95 | 0.206 | 0.255 | A | 294.0 | 290.0 | 0 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 7apf | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 4e-80 | 274.8 | 1.0 | 260.0 | 260.0 | 966 | 967 | 968 | 970 | 972 | 855 | 871 | 875 | 946 | 948 | 947 | 949.0 | 1009 | 997 | 992 | 991 | 990 | 989 | 988 | 987 | 986 | 903 | Tyrosine-protein kinase JAK3 |
| TYR | JAK3-2 | JAK3_HUMAN | 7APFB | P52333 | 814 | 1103 | 1124.0 | RQZ:1201 | Type1 | Inactive | DFGin | 6.2636 | 13.9552 | BLAminus | -125.48, -163.38 | 48.35, 84.73 | -99.0, 25.48 | 280.41, 70.13 | -63.69, -28.85 | in-in | in | 8.0989 | Saltbr-in | 2.7319 | HRD-in | -80.63, -44.7 | 74.93, -48.31 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7771 | ActLoopCT-out | TYR | APEdihe_iiiai | APEdist_aaao | APE10-dihe-in | -141.78, 126.08 | APE9-dihe-in | -146.46, 155.19 | APE8-dihe-in | -90.31, 98.72 | APE8-rot-na | 9.96 | APE67-dihe-in | -78.0, -2.22 | -75.31, -23.81 | APE12-dist-na | 9.6188 | APE11-dist-na | 13.0285 | APE10-dist-na | 12.5423 | APE9-dist-out | 9.1313 | None | None | None | XRAY | 1.95 | 0.206 | 0.255 | B | 294.0 | 285.0 | 5 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 7apf | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 4e-80 | 274.8 | 1.0 | 260.0 | 260.0 | 966 | 967 | 968 | 970 | 972 | 855 | 871 | 875 | 946 | 948 | 947 | 949.0 | 1009 | 997 | 992 | 991 | 990 | 989 | 988 | 987 | 986 | 903 | Tyrosine-protein kinase JAK3 |
| 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 |
|---|