Ligand: XZS

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% 6VNHA
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 6VNHA O60674 840 1132 1132.0 XZS:61201 Type1 Inactive DFGin 6.1841 13.5527 ABAminus -123.6, 24.97 -161.82, 132.95 -130.5, 37.69 300.8, 91.36 -67.84, -25.06 in-in in 8.4289 Saltbr-in 2.7903 HRD-in -79.9, -37.99 68.88, -41.62 in-in-in SNCiii in-in ActLoopNT-in 2.842 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -83.96, 147.55 APE9-dihe-in -142.31, 115.2 APE8-dihe-in -71.26, 87.66 APE8-rot-na 26.81 APE67-dihe-in -79.29, -8.01 -67.64, -27.75 APE12-dist-na 13.1613 APE11-dist-na 9.563 APE10-dist-na 9.2404 APE9-dist-in 7.5629 None PTR1007 PTR1007 XRAY 2.4 0.231 0.267 A 308.0 293.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 6vnh TYR_JAK2-2_HUMAN TYR 2.9e-87 298.2 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 6VNHB O60674 843 1131 1132.0 XZS:61201 Type1 Inactive DFGin 5.9849 13.6918 ABAminus -107.49, 3.1 -151.23, 145.03 -137.2, 27.68 297.12, 87.64 -65.09, -22.9 in-in in 8.7024 Saltbr-in 2.5671 HRD-in -73.62, -34.79 67.37, -46.78 in-in-out SNCiio in-out ActLoopNT-in 2.8967 ActLoopCT-out TYR APEdihe_iiiai APEdist_aaao APE10-dihe-in -67.53, 130.24 APE9-dihe-in -117.53, 132.31 APE8-dihe-in -69.15, 74.29 APE8-rot-na 26.97 APE67-dihe-in -84.52, -2.56 -66.6, -16.86 APE12-dist-na 13.2952 APE11-dist-na 12.3836 APE10-dist-na 12.8159 APE9-dist-out 8.8729 None PTR1007 PTR1007 XRAY 2.4 0.231 0.267 B 308.0 289.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 6vnh TYR_JAK2-2_HUMAN TYR 2.9e-87 298.2 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: XZS

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% 6VNHA
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 6VNHA O60674 840 1132 1132.0 XZS:61201 Type1 Inactive DFGin 6.1841 13.5527 ABAminus -123.6, 24.97 -161.82, 132.95 -130.5, 37.69 300.8, 91.36 -67.84, -25.06 in-in in 8.4289 Saltbr-in 2.7903 HRD-in -79.9, -37.99 68.88, -41.62 in-in-in SNCiii in-in ActLoopNT-in 2.842 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -83.96, 147.55 APE9-dihe-in -142.31, 115.2 APE8-dihe-in -71.26, 87.66 APE8-rot-na 26.81 APE67-dihe-in -79.29, -8.01 -67.64, -27.75 APE12-dist-na 13.1613 APE11-dist-na 9.563 APE10-dist-na 9.2404 APE9-dist-in 7.5629 None PTR1007 PTR1007 XRAY 2.4 0.231 0.267 A 308.0 293.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 6vnh Homo sapiens TYR_JAK2-2_HUMAN TYR 2.9e-87 298.2 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 6VNHB O60674 843 1131 1132.0 XZS:61201 Type1 Inactive DFGin 5.9849 13.6918 ABAminus -107.49, 3.1 -151.23, 145.03 -137.2, 27.68 297.12, 87.64 -65.09, -22.9 in-in in 8.7024 Saltbr-in 2.5671 HRD-in -73.62, -34.79 67.37, -46.78 in-in-out SNCiio in-out ActLoopNT-in 2.8967 ActLoopCT-out TYR APEdihe_iiiai APEdist_aaao APE10-dihe-in -67.53, 130.24 APE9-dihe-in -117.53, 132.31 APE8-dihe-in -69.15, 74.29 APE8-rot-na 26.97 APE67-dihe-in -84.52, -2.56 -66.6, -16.86 APE12-dist-na 13.2952 APE11-dist-na 12.3836 APE10-dist-na 12.8159 APE9-dist-out 8.8729 None PTR1007 PTR1007 XRAY 2.4 0.231 0.267 B 308.0 289.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 6vnh Homo sapiens TYR_JAK2-2_HUMAN TYR 2.9e-87 298.2 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: XZS

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