Ligand: 50V

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 5CF8A
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 5CF8A O60674 842 1132 1132.0 50V:64000 Type1 Inactive DFGin 6.3195 13.6097 ABAminus -111.5, 5.34 -159.98, 145.11 -133.05, 28.13 292.06, 92.11 -55.99, -28.41 in-in in 8.5186 Saltbr-in 2.6991 HRD-in -68.8, -45.07 66.6, 4.57 in-in-in SNCiii in-in ActLoopNT-in 2.8073 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -84.77, 124.44 APE9-dihe-in -93.29, 144.71 APE8-dihe-in -78.53, 70.36 APE8-rot-na 30.49 APE67-dihe-in -76.87, -0.84 -55.83, -30.99 APE12-dist-na 12.9462 APE11-dist-na 11.7727 APE10-dist-na 12.8076 APE9-dist-in 7.7505 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 1.8 0.191 0.204 A 301.0 286.0 5 31 31 0 [[545, 807], [849, 1125]] 2.0 5cf8 TYR_JAK2-2_HUMAN TYR 2.7e-87 298.4 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 5CF8B O60674 839 1132 1132.0 50V:64000 Type1 Inactive DFGin 6.4348 13.6923 ABAminus -110.5, 4.8 -158.24, 144.72 -132.59, 27.56 291.52, 92.27 -58.53, -26.74 in-in in 8.4534 Saltbr-in 2.7312 HRD-in -69.62, -45.44 67.63, 3.37 in-in-out SNCiio in-out ActLoopNT-in 2.8079 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 60.73, 91.69 APE9-dihe-in -118.13, 144.09 APE8-dihe-in -78.0, 69.71 APE8-rot-na 28.79 APE67-dihe-in -78.53, -1.18 -55.41, -30.41 APE12-dist-na 10.2874 APE11-dist-na 11.0805 APE10-dist-na 11.8689 APE9-dist-in 7.7441 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 1.8 0.191 0.204 B 301.0 289.0 5 31 31 0 [[545, 807], [849, 1125]] 2.0 5cf8 TYR_JAK2-2_HUMAN TYR 2.7e-87 298.4 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: 50V

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 5CF8A
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 5CF8A O60674 842 1132 1132.0 50V:64000 Type1 Inactive DFGin 6.3195 13.6097 ABAminus -111.5, 5.34 -159.98, 145.11 -133.05, 28.13 292.06, 92.11 -55.99, -28.41 in-in in 8.5186 Saltbr-in 2.6991 HRD-in -68.8, -45.07 66.6, 4.57 in-in-in SNCiii in-in ActLoopNT-in 2.8073 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -84.77, 124.44 APE9-dihe-in -93.29, 144.71 APE8-dihe-in -78.53, 70.36 APE8-rot-na 30.49 APE67-dihe-in -76.87, -0.84 -55.83, -30.99 APE12-dist-na 12.9462 APE11-dist-na 11.7727 APE10-dist-na 12.8076 APE9-dist-in 7.7505 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 1.8 0.191 0.204 A 301.0 286.0 5 31 31 0 [[545, 807], [849, 1125]] 2.0 5cf8 Homo sapiens TYR_JAK2-2_HUMAN TYR 2.7e-87 298.4 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 5CF8B O60674 839 1132 1132.0 50V:64000 Type1 Inactive DFGin 6.4348 13.6923 ABAminus -110.5, 4.8 -158.24, 144.72 -132.59, 27.56 291.52, 92.27 -58.53, -26.74 in-in in 8.4534 Saltbr-in 2.7312 HRD-in -69.62, -45.44 67.63, 3.37 in-in-out SNCiio in-out ActLoopNT-in 2.8079 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 60.73, 91.69 APE9-dihe-in -118.13, 144.09 APE8-dihe-in -78.0, 69.71 APE8-rot-na 28.79 APE67-dihe-in -78.53, -1.18 -55.41, -30.41 APE12-dist-na 10.2874 APE11-dist-na 11.0805 APE10-dist-na 11.8689 APE9-dist-in 7.7441 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 1.8 0.191 0.204 B 301.0 289.0 5 31 31 0 [[545, 807], [849, 1125]] 2.0 5cf8 Homo sapiens TYR_JAK2-2_HUMAN TYR 2.7e-87 298.4 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: 50V

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