| 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 | JAK1-2 | JAK1_HUMAN | 6RSCA | P23458 | 865 | 1154 | 1154.0 | KH5:1201 | Type1 | Inactive | DFGin | 6.5538 | 13.4092 | ABAminus | -117.31, 8.47 | -153.39, 137.28 | -129.48, 30.56 | 297.53, 83.92 | -65.76, -23.88 | in-in | in | 7.6629 | Saltbr-in | 2.6894 | HRD-in | -79.6, -49.32 | 70.06, 11.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7172 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -98.9, 27.5 | APE9-dihe-in | -67.04, 137.63 | APE8-dihe-in | -80.21, 78.36 | APE8-rot-na | 37.08 | APE67-dihe-in | -76.89, -0.21 | -62.94, -28.86 | APE12-dist-na | 11.0035 | APE11-dist-na | 13.5759 | APE10-dist-na | 10.2308 | APE9-dist-in | 6.8584 | None | PTR1034,PTR1035 | PTR1034,PTR1035 | XRAY | 1.85 | 0.249 | 0.28 | A | 302.0 | 286.0 | 4 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | 6rsc | TYR_JAK1-2_HUMAN | TYR | 2.2e-87 | 298.6 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| TYR | JAK1-2 | JAK1_HUMAN | 6RSCB | P23458 | 865 | 1154 | 1154.0 | KH5:1201 | Type1 | Inactive | DFGin | 6.5561 | 13.712 | ABAminus | -118.51, -2.16 | -150.35, 139.43 | -132.07, 31.9 | 298.68, 77.43 | -57.63, -28.0 | in-in | in | 7.9025 | Saltbr-in | 2.662 | HRD-in | -78.87, -51.69 | 73.77, 10.39 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9169 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -100.91, 33.47 | APE9-dihe-in | -66.35, 135.05 | APE8-dihe-in | -77.66, 75.63 | APE8-rot-na | 31.23 | APE67-dihe-in | -74.4, -5.72 | -63.02, -28.16 | APE12-dist-na | 11.1417 | APE11-dist-na | 13.5111 | APE10-dist-na | 10.263 | APE9-dist-in | 6.9184 | None | PTR1034,PTR1035 | PTR1034,PTR1035 | XRAY | 1.85 | 0.249 | 0.28 | B | 302.0 | 281.0 | 9 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | 6rsc | TYR_JAK1-2_HUMAN | TYR | 2.2e-87 | 298.6 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| 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 | JAK1-2 | JAK1_HUMAN | 6RSCA | P23458 | 865 | 1154 | 1154.0 | KH5:1201 | Type1 | Inactive | DFGin | 6.5538 | 13.4092 | ABAminus | -117.31, 8.47 | -153.39, 137.28 | -129.48, 30.56 | 297.53, 83.92 | -65.76, -23.88 | in-in | in | 7.6629 | Saltbr-in | 2.6894 | HRD-in | -79.6, -49.32 | 70.06, 11.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7172 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -98.9, 27.5 | APE9-dihe-in | -67.04, 137.63 | APE8-dihe-in | -80.21, 78.36 | APE8-rot-na | 37.08 | APE67-dihe-in | -76.89, -0.21 | -62.94, -28.86 | APE12-dist-na | 11.0035 | APE11-dist-na | 13.5759 | APE10-dist-na | 10.2308 | APE9-dist-in | 6.8584 | None | PTR1034,PTR1035 | PTR1034,PTR1035 | XRAY | 1.85 | 0.249 | 0.28 | A | 302.0 | 286.0 | 4 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | 6rsc | Homo sapiens | TYR_JAK1-2_HUMAN | TYR | 2.2e-87 | 298.6 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| TYR | JAK1-2 | JAK1_HUMAN | 6RSCB | P23458 | 865 | 1154 | 1154.0 | KH5:1201 | Type1 | Inactive | DFGin | 6.5561 | 13.712 | ABAminus | -118.51, -2.16 | -150.35, 139.43 | -132.07, 31.9 | 298.68, 77.43 | -57.63, -28.0 | in-in | in | 7.9025 | Saltbr-in | 2.662 | HRD-in | -78.87, -51.69 | 73.77, 10.39 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9169 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaai | APE10-dihe-out | -100.91, 33.47 | APE9-dihe-in | -66.35, 135.05 | APE8-dihe-in | -77.66, 75.63 | APE8-rot-na | 31.23 | APE67-dihe-in | -74.4, -5.72 | -63.02, -28.16 | APE12-dist-na | 11.1417 | APE11-dist-na | 13.5111 | APE10-dist-na | 10.263 | APE9-dist-in | 6.9184 | None | PTR1034,PTR1035 | PTR1034,PTR1035 | XRAY | 1.85 | 0.249 | 0.28 | B | 302.0 | 281.0 | 9 | 31 | 31 | 0 | [[583, 847], [875, 1151]] | 2.0 | 6rsc | Homo sapiens | TYR_JAK1-2_HUMAN | TYR | 2.2e-87 | 298.6 | 2.0 | 259.0 | 258.0 | 1020 | 1021 | 1022 | 1024 | 1026 | 908 | 925 | 929 | 1000 | 1002 | 1001 | 1003.0 | 1063 | 1051 | 1046 | 1045 | 1044 | 1043 | 1042 | 1041 | 1040 | 957 | Tyrosine-protein kinase JAK1 |
| 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 |
|---|