| 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 | 6AAKA | P52333 | 815 | 1098 | 1124.0 | 9T6:1201 | Type1 | Inactive | DFGin | 6.4258 | 14.4877 | BLAminus | -141.28, -175.48 | 60.31, 80.99 | -97.75, 30.98 | 284.74, 77.33 | -61.02, -46.05 | in-in | in | 8.5254 | Saltbr-in | 2.67 | HRD-in | -75.62, -45.99 | 77.6, -18.1 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7362 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -74.2, -11.07 | APE9-dihe-in | -68.95, 155.07 | APE8-dihe-in | -47.57, 131.1 | APE8-rot-na | 329.72 | APE67-dihe-in | -73.4, -26.9 | -66.76, -22.48 | APE12-dist-na | 11.9929 | APE11-dist-na | 8.6734 | APE10-dist-na | 11.3981 | APE9-dist-in | 7.4704 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | A | 287.0 | 277.0 | 7 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKB | P52333 | 815 | 1100 | 1124.0 | 9T6:1201 | Type1 | Inactive | DFGin | 6.549 | 14.3135 | BLAminus | -132.57, -171.05 | 56.03, 83.09 | -98.42, 24.6 | 281.38, 75.24 | -63.47, -40.11 | in-in | in | 8.0358 | Saltbr-in | 2.7546 | HRD-in | -65.5, -48.18 | 78.33, -13.38 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9074 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -123.61, -28.55 | APE9-dihe-in | -64.46, 151.35 | APE8-dihe-in | -40.19, 130.42 | APE8-rot-na | 326.93 | APE67-dihe-in | -77.17, -14.56 | -72.74, -10.57 | APE12-dist-na | 13.1081 | APE11-dist-na | 9.526 | APE10-dist-na | 10.0845 | APE9-dist-in | 7.2029 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | B | 287.0 | 285.0 | 1 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKC | P52333 | 814 | 1099 | 1124.0 | 9T6:1201 | Type1 | Active | DFGin | 6.7877 | 14.6346 | BLAminus | -114.47, 172.4 | 69.03, 86.81 | -107.19, 29.58 | 286.76, 78.99 | -58.47, -55.72 | in-in | in | 8.2406 | Saltbr-in | 2.7237 | HRD-in | -89.94, -41.82 | 71.73, -3.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7832 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -68.85, 76.94 | APE9-dihe-in | -171.36, 163.86 | APE8-dihe-in | -58.47, 128.31 | APE8-rot-na | 338.62 | APE67-dihe-in | -73.56, -5.95 | -79.88, -15.99 | APE12-dist-na | 12.9746 | APE11-dist-na | 9.2183 | APE10-dist-na | 10.3986 | APE9-dist-in | 7.7513 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | C | 287.0 | 276.0 | 10 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKD | P52333 | 814 | 1098 | 1124.0 | 9T6:1201 | Type1 | None | DFGin | 6.3309 | 14.1383 | BLAminus | -145.03, 168.99 | 56.55, 97.11 | -103.75, 32.24 | 293.47, 81.71 | -62.01, -33.71 | in-in | in | 8.0179 | Saltbr-in | 2.8556 | HRD-in | -76.49, -42.81 | 76.74, -36.27 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.7662 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 72.65 | APE8-dihe-in | -50.29, 134.06 | APE8-rot-na | 332.19 | APE67-dihe-in | -63.85, -16.03 | -70.13, -20.9 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 7.3842 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | D | 287.0 | 268.0 | 17 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 6aak | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKA | P52333 | 815 | 1098 | 1124.0 | 9T6:1201 | Type1 | Inactive | DFGin | 6.4258 | 14.4877 | BLAminus | -141.28, -175.48 | 60.31, 80.99 | -97.75, 30.98 | 284.74, 77.33 | -61.02, -46.05 | in-in | in | 8.5254 | Saltbr-in | 2.67 | HRD-in | -75.62, -45.99 | 77.6, -18.1 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7362 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -74.2, -11.07 | APE9-dihe-in | -68.95, 155.07 | APE8-dihe-in | -47.57, 131.1 | APE8-rot-na | 329.72 | APE67-dihe-in | -73.4, -26.9 | -66.76, -22.48 | APE12-dist-na | 11.9929 | APE11-dist-na | 8.6734 | APE10-dist-na | 11.3981 | APE9-dist-in | 7.4704 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | A | 287.0 | 277.0 | 7 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKB | P52333 | 815 | 1100 | 1124.0 | 9T6:1201 | Type1 | Inactive | DFGin | 6.549 | 14.3135 | BLAminus | -132.57, -171.05 | 56.03, 83.09 | -98.42, 24.6 | 281.38, 75.24 | -63.47, -40.11 | in-in | in | 8.0358 | Saltbr-in | 2.7546 | HRD-in | -65.5, -48.18 | 78.33, -13.38 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9074 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -123.61, -28.55 | APE9-dihe-in | -64.46, 151.35 | APE8-dihe-in | -40.19, 130.42 | APE8-rot-na | 326.93 | APE67-dihe-in | -77.17, -14.56 | -72.74, -10.57 | APE12-dist-na | 13.1081 | APE11-dist-na | 9.526 | APE10-dist-na | 10.0845 | APE9-dist-in | 7.2029 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | B | 287.0 | 285.0 | 1 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKC | P52333 | 814 | 1099 | 1124.0 | 9T6:1201 | Type1 | Active | DFGin | 6.7877 | 14.6346 | BLAminus | -114.47, 172.4 | 69.03, 86.81 | -107.19, 29.58 | 286.76, 78.99 | -58.47, -55.72 | in-in | in | 8.2406 | Saltbr-in | 2.7237 | HRD-in | -89.94, -41.82 | 71.73, -3.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7832 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -68.85, 76.94 | APE9-dihe-in | -171.36, 163.86 | APE8-dihe-in | -58.47, 128.31 | APE8-rot-na | 338.62 | APE67-dihe-in | -73.56, -5.95 | -79.88, -15.99 | APE12-dist-na | 12.9746 | APE11-dist-na | 9.2183 | APE10-dist-na | 10.3986 | APE9-dist-in | 7.7513 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | C | 287.0 | 276.0 | 10 | 31 | 31 | 0 | [[521, 779], [822, 1097]] | 2.0 | 6aak | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 | 6AAKD | P52333 | 814 | 1098 | 1124.0 | 9T6:1201 | Type1 | None | DFGin | 6.3309 | 14.1383 | BLAminus | -145.03, 168.99 | 56.55, 97.11 | -103.75, 32.24 | 293.47, 81.71 | -62.01, -33.71 | in-in | in | 8.0179 | Saltbr-in | 2.8556 | HRD-in | -76.49, -42.81 | 76.74, -36.27 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.7662 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 72.65 | APE8-dihe-in | -50.29, 134.06 | APE8-rot-na | 332.19 | APE67-dihe-in | -63.85, -16.03 | -70.13, -20.9 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 7.3842 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.67 | 0.269 | 0.326 | D | 287.0 | 268.0 | 17 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 6aak | Homo sapiens | TYR_JAK3-2_HUMAN | TYR | 1.9e-81 | 279.1 | 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 |
|---|