Ligand: O19

Total number of chains: 4
Active chains: 4
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 4BBFA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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 4BBFA O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.3097 13.6819 BLAminus -122.28, 157.21 62.91, 103.68 -120.19, 22.73 295.23, 86.2 -48.8, -35.8 in-in in 8.4184 Saltbr-in 2.631 HRD-in -73.08, -45.64 68.9, 4.29 in-in-in SNCiii in-in ActLoopNT-in 2.7195 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -75.01, 125.11 APE9-dihe-in -136.65, 156.16 APE8-dihe-in -79.26, 68.68 APE8-rot-na 35.28 APE67-dihe-in -75.77, -5.49 -52.84, -31.24 APE12-dist-na 9.2357 APE11-dist-na 12.5782 APE10-dist-na 12.0698 APE9-dist-in 7.4835 D976N None None XRAY 2.0 0.232 0.289 A 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFB O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.5791 14.1524 BLAminus -105.04, -155.04 19.23, 107.45 -113.45, 24.27 291.25, 95.72 -57.33, -30.87 in-in in 8.405 Saltbr-in 2.7187 HRD-in -66.38, -45.27 65.07, 1.26 in-in-in SNCiii in-in ActLoopNT-in 2.7393 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -88.58, 126.22 APE9-dihe-in -128.56, 154.33 APE8-dihe-in -77.1, 75.24 APE8-rot-na 35.98 APE67-dihe-in -81.26, -2.64 -63.77, -23.03 APE12-dist-na 8.4389 APE11-dist-na 12.9748 APE10-dist-na 12.7639 APE9-dist-in 7.646 D976N None None XRAY 2.0 0.232 0.289 B 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFC O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.5393 14.1306 BLAminus -104.07, -172.68 36.61, 102.28 -115.67, 23.77 291.54, 96.27 -45.14, -34.47 in-in in 8.4607 Saltbr-in 2.7587 HRD-in -62.09, -47.1 70.38, 6.53 in-in-in SNCiii in-in ActLoopNT-in 2.7017 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -93.18, 129.11 APE9-dihe-in -138.58, 151.05 APE8-dihe-in -77.24, 74.09 APE8-rot-na 32.23 APE67-dihe-in -82.19, -2.12 -57.96, -26.71 APE12-dist-na 9.8206 APE11-dist-na 13.1041 APE10-dist-na 11.9982 APE9-dist-in 7.6648 D976N None None XRAY 2.0 0.232 0.289 C 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFD O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.2856 13.5139 BLAminus -118.87, 148.23 73.97, 103.66 -117.83, 24.63 298.53, 82.83 -57.3, -34.26 in-in in 8.3507 Saltbr-in 2.6703 HRD-in -74.8, -46.04 69.77, 0.83 in-in-in SNCiii in-in ActLoopNT-in 2.741 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.36, 121.84 APE9-dihe-in -135.14, 154.38 APE8-dihe-in -81.18, 76.48 APE8-rot-na 38.95 APE67-dihe-in -79.95, -2.38 -61.79, -29.08 APE12-dist-na 8.0226 APE11-dist-na 12.5205 APE10-dist-na 11.9304 APE9-dist-in 7.3831 D976N None None XRAY 2.0 0.232 0.289 D 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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

Ligand: O19

Total number of chains: 4
Active chains: 4
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 4BBFA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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 4BBFA O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.3097 13.6819 BLAminus -122.28, 157.21 62.91, 103.68 -120.19, 22.73 295.23, 86.2 -48.8, -35.8 in-in in 8.4184 Saltbr-in 2.631 HRD-in -73.08, -45.64 68.9, 4.29 in-in-in SNCiii in-in ActLoopNT-in 2.7195 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -75.01, 125.11 APE9-dihe-in -136.65, 156.16 APE8-dihe-in -79.26, 68.68 APE8-rot-na 35.28 APE67-dihe-in -75.77, -5.49 -52.84, -31.24 APE12-dist-na 9.2357 APE11-dist-na 12.5782 APE10-dist-na 12.0698 APE9-dist-in 7.4835 D976N None None XRAY 2.0 0.232 0.289 A 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf Homo sapiens TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFB O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.5791 14.1524 BLAminus -105.04, -155.04 19.23, 107.45 -113.45, 24.27 291.25, 95.72 -57.33, -30.87 in-in in 8.405 Saltbr-in 2.7187 HRD-in -66.38, -45.27 65.07, 1.26 in-in-in SNCiii in-in ActLoopNT-in 2.7393 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -88.58, 126.22 APE9-dihe-in -128.56, 154.33 APE8-dihe-in -77.1, 75.24 APE8-rot-na 35.98 APE67-dihe-in -81.26, -2.64 -63.77, -23.03 APE12-dist-na 8.4389 APE11-dist-na 12.9748 APE10-dist-na 12.7639 APE9-dist-in 7.646 D976N None None XRAY 2.0 0.232 0.289 B 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf Homo sapiens TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFC O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.5393 14.1306 BLAminus -104.07, -172.68 36.61, 102.28 -115.67, 23.77 291.54, 96.27 -45.14, -34.47 in-in in 8.4607 Saltbr-in 2.7587 HRD-in -62.09, -47.1 70.38, 6.53 in-in-in SNCiii in-in ActLoopNT-in 2.7017 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -93.18, 129.11 APE9-dihe-in -138.58, 151.05 APE8-dihe-in -77.24, 74.09 APE8-rot-na 32.23 APE67-dihe-in -82.19, -2.12 -57.96, -26.71 APE12-dist-na 9.8206 APE11-dist-na 13.1041 APE10-dist-na 11.9982 APE9-dist-in 7.6648 D976N None None XRAY 2.0 0.232 0.289 C 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf Homo sapiens TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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 4BBFD O60674 841 1128 1132.0 O19:2229 Type1 Active DFGin 6.2856 13.5139 BLAminus -118.87, 148.23 73.97, 103.66 -117.83, 24.63 298.53, 82.83 -57.3, -34.26 in-in in 8.3507 Saltbr-in 2.6703 HRD-in -74.8, -46.04 69.77, 0.83 in-in-in SNCiii in-in ActLoopNT-in 2.741 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.36, 121.84 APE9-dihe-in -135.14, 154.38 APE8-dihe-in -81.18, 76.48 APE8-rot-na 38.95 APE67-dihe-in -79.95, -2.38 -61.79, -29.08 APE12-dist-na 8.0226 APE11-dist-na 12.5205 APE10-dist-na 11.9304 APE9-dist-in 7.3831 D976N None None XRAY 2.0 0.232 0.289 D 298.0 288.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4bbf Homo sapiens TYR_JAK2-2_HUMAN TYR 9.7e-87 296.5 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

Ligand: O19

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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