| 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 | 5W86A | P52333 | 814 | 1098 | 1124.0 | 9YV:4000 | Type1 | Inactive | DFGin | 6.508 | 14.2333 | BLAminus | -130.78, -178.04 | 55.33, 86.29 | -99.45, 24.99 | 285.64, 80.91 | -59.45, -36.09 | in-in | in | 8.3613 | Saltbr-in | 2.7197 | HRD-in | -61.74, -49.91 | 79.02, -19.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8338 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -62.63 | APE8-dihe-in | -73.09, 69.06 | APE8-rot-na | 28.5 | APE67-dihe-in | -76.22, -6.14 | -68.16, -24.91 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.3257 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | A | 287.0 | 271.0 | 14 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86B | P52333 | 816 | 1098 | 1124.0 | 9YV:4000 | Type1 | None | DFGin | 6.5719 | 14.1258 | BLAminus | -130.89, -177.7 | 55.33, 86.59 | -98.74, 23.53 | 285.65, 80.73 | -58.36, -36.34 | in-in | in | 8.1755 | Saltbr-in | 2.7815 | HRD-in | -61.09, -43.56 | 75.39, -22.05 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8266 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-in | -98.06, 144.28 | APE8-rot-na | 28.22 | APE67-dihe-in | -84.46, -5.87 | -122.29, -17.07 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 7.7561 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | B | 287.0 | 269.0 | 14 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86C | P52333 | 814 | 1099 | 1124.0 | 9YV:4000 | Type1 | None | DFGin | 6.5069 | 14.1113 | BLAminus | -131.5, -178.51 | 55.57, 86.1 | -97.59, 23.31 | 285.7, 80.13 | -57.67, -36.43 | in-in | in | 8.1655 | Saltbr-in | 2.9403 | HRD-in | -62.63, -48.44 | 77.31, -20.33 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8223 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, -67.29 | APE8-rot-na | 15.79 | APE67-dihe-in | -70.13, -18.29 | -58.03, -20.5 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | C | 287.0 | 275.0 | 11 | 31 | 25 | 6 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86D | P52333 | 814 | 1099 | 1124.0 | 9YV:4000 | Type1 | Inactive | DFGin | 6.5614 | 14.2551 | BLAminus | -130.88, -178.77 | 56.18, 85.97 | -99.02, 25.19 | 285.73, 80.24 | -59.91, -34.36 | in-in | in | 8.1827 | Saltbr-in | 2.7569 | HRD-in | -62.59, -49.55 | 78.85, -19.41 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.814 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -64.08 | APE8-dihe-in | -73.59, 57.74 | APE8-rot-na | 27.09 | APE67-dihe-in | -73.08, -10.82 | -59.31, -28.98 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.2414 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | D | 287.0 | 274.0 | 12 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86A | P52333 | 814 | 1098 | 1124.0 | 9YV:4000 | Type1 | Inactive | DFGin | 6.508 | 14.2333 | BLAminus | -130.78, -178.04 | 55.33, 86.29 | -99.45, 24.99 | 285.64, 80.91 | -59.45, -36.09 | in-in | in | 8.3613 | Saltbr-in | 2.7197 | HRD-in | -61.74, -49.91 | 79.02, -19.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8338 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -62.63 | APE8-dihe-in | -73.09, 69.06 | APE8-rot-na | 28.5 | APE67-dihe-in | -76.22, -6.14 | -68.16, -24.91 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.3257 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | A | 287.0 | 271.0 | 14 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86B | P52333 | 816 | 1098 | 1124.0 | 9YV:4000 | Type1 | None | DFGin | 6.5719 | 14.1258 | BLAminus | -130.89, -177.7 | 55.33, 86.59 | -98.74, 23.53 | 285.65, 80.73 | -58.36, -36.34 | in-in | in | 8.1755 | Saltbr-in | 2.7815 | HRD-in | -61.09, -43.56 | 75.39, -22.05 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8266 | ActLoopCT-none | TYR | APEdihe_nniai | APEdist_aaai | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-in | -98.06, 144.28 | APE8-rot-na | 28.22 | APE67-dihe-in | -84.46, -5.87 | -122.29, -17.07 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-in | 7.7561 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | B | 287.0 | 269.0 | 14 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86C | P52333 | 814 | 1099 | 1124.0 | 9YV:4000 | Type1 | None | DFGin | 6.5069 | 14.1113 | BLAminus | -131.5, -178.51 | 55.57, 86.1 | -97.59, 23.31 | 285.7, 80.13 | -57.67, -36.43 | in-in | in | 8.1655 | Saltbr-in | 2.9403 | HRD-in | -62.63, -48.44 | 77.31, -20.33 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8223 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, -67.29 | APE8-rot-na | 15.79 | APE67-dihe-in | -70.13, -18.29 | -58.03, -20.5 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | C | 287.0 | 275.0 | 11 | 31 | 25 | 6 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 | 5W86D | P52333 | 814 | 1099 | 1124.0 | 9YV:4000 | Type1 | Inactive | DFGin | 6.5614 | 14.2551 | BLAminus | -130.88, -178.77 | 56.18, 85.97 | -99.02, 25.19 | 285.73, 80.24 | -59.91, -34.36 | in-in | in | 8.1827 | Saltbr-in | 2.7569 | HRD-in | -62.59, -49.55 | 78.85, -19.41 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.814 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, -64.08 | APE8-dihe-in | -73.59, 57.74 | APE8-rot-na | 27.09 | APE67-dihe-in | -73.08, -10.82 | -59.31, -28.98 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.2414 | C1040S,C1048S | PTR980,PTR981 | PTR980,PTR981 | XRAY | 2.61 | 0.211 | 0.264 | D | 287.0 | 274.0 | 12 | 31 | 26 | 5 | [[521, 779], [822, 1097]] | 2.0 | 5w86 | 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 |
|---|