Ligand: NVB

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% 3LPBB
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 3LPBA O60674 842 1131 1132.0 NVB:61133 Type1 Inactive DFGin 6.2523 13.4713 ABAminus -118.13, 3.49 -150.26, 140.34 -128.73, 24.71 296.89, 86.22 -55.47, -30.57 in-in in 8.5519 Saltbr-in 2.5799 HRD-in -69.29, -46.76 69.54, 5.53 in-in-in SNCiii in-in ActLoopNT-in 2.8352 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -79.85, 115.06 APE9-dihe-in -78.93, 143.76 APE8-dihe-in -77.26, 67.49 APE8-rot-na 32.29 APE67-dihe-in -78.53, -4.63 -55.18, -29.06 APE12-dist-na 12.878 APE11-dist-na 11.6853 APE10-dist-na 13.1126 APE9-dist-in 7.9116 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.0 0.178 0.207 A 295.0 280.0 10 31 31 0 [[545, 807], [849, 1125]] 2.0 3lpb TYR_JAK2-2_HUMAN TYR 2.5e-87 298.5 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 3LPBB O60674 840 1132 1132.0 NVB:61133 Type1 Inactive DFGin 6.414 13.6312 ABAminus -111.19, 1.19 -153.19, 136.07 -126.66, 23.99 296.66, 80.96 -51.9, -31.54 in-in in 8.4287 Saltbr-in 2.7946 HRD-in -80.7, -45.59 69.18, -7.08 in-in-none SNCiin in-none ActLoopNT-in 2.7157 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 123.25 APE9-dihe-in -129.24, 142.1 APE8-dihe-in -77.96, 73.49 APE8-rot-na 29.39 APE67-dihe-in -79.17, -1.43 -62.85, -28.79 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 11.9809 APE9-dist-in 7.6813 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.0 0.178 0.207 B 295.0 285.0 8 31 28 3 [[545, 807], [849, 1125]] 2.0 3lpb TYR_JAK2-2_HUMAN TYR 2.5e-87 298.5 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: NVB

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% 3LPBB
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 3LPBA O60674 842 1131 1132.0 NVB:61133 Type1 Inactive DFGin 6.2523 13.4713 ABAminus -118.13, 3.49 -150.26, 140.34 -128.73, 24.71 296.89, 86.22 -55.47, -30.57 in-in in 8.5519 Saltbr-in 2.5799 HRD-in -69.29, -46.76 69.54, 5.53 in-in-in SNCiii in-in ActLoopNT-in 2.8352 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -79.85, 115.06 APE9-dihe-in -78.93, 143.76 APE8-dihe-in -77.26, 67.49 APE8-rot-na 32.29 APE67-dihe-in -78.53, -4.63 -55.18, -29.06 APE12-dist-na 12.878 APE11-dist-na 11.6853 APE10-dist-na 13.1126 APE9-dist-in 7.9116 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.0 0.178 0.207 A 295.0 280.0 10 31 31 0 [[545, 807], [849, 1125]] 2.0 3lpb Homo sapiens TYR_JAK2-2_HUMAN TYR 2.5e-87 298.5 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 3LPBB O60674 840 1132 1132.0 NVB:61133 Type1 Inactive DFGin 6.414 13.6312 ABAminus -111.19, 1.19 -153.19, 136.07 -126.66, 23.99 296.66, 80.96 -51.9, -31.54 in-in in 8.4287 Saltbr-in 2.7946 HRD-in -80.7, -45.59 69.18, -7.08 in-in-none SNCiin in-none ActLoopNT-in 2.7157 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 123.25 APE9-dihe-in -129.24, 142.1 APE8-dihe-in -77.96, 73.49 APE8-rot-na 29.39 APE67-dihe-in -79.17, -1.43 -62.85, -28.79 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 11.9809 APE9-dist-in 7.6813 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.0 0.178 0.207 B 295.0 285.0 8 31 28 3 [[545, 807], [849, 1125]] 2.0 3lpb Homo sapiens TYR_JAK2-2_HUMAN TYR 2.5e-87 298.5 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: NVB

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