Ligand: 0X5

Total number of chains: 2
Active chains: 1
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 4GIHA
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 4GMYA O60674 833 1132 1132.0 0X5:1201 Type1 Active DFGin 6.3229 14.3677 BLAminus -129.14, -151.03 59.75, 56.19 -91.99, 15.7 291.11, 106.6 -64.82, -18.52 in-in in 8.6089 Saltbr-in 2.934 HRD-in -66.28, -44.86 75.83, -6.94 in-in-in SNCiii in-in ActLoopNT-in 2.7483 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.06, 153.62 APE9-dihe-in -126.47, 151.79 APE8-dihe-in -73.92, 63.65 APE8-rot-na 25.85 APE67-dihe-in -78.85, -1.67 -58.34, -29.64 APE12-dist-na 13.1569 APE11-dist-na 13.0705 APE10-dist-na 13.2143 APE9-dist-in 7.8755 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.403 0.167 0.233 A 302.0 300.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4gmy TYR_JAK2-2_HUMAN TYR 2.7e-87 298.3 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 TYK2-2 TYK2_HUMAN 4GIHA P29597 890 1176 1187.0 0X5:61201 Type1 Inactive DFGin 6.6069 13.9542 BLAminus -120.14, -171.23 42.64, 89.76 -99.46, 23.47 285.31, 88.12 -62.7, -22.0 in-in in 8.2325 Saltbr-in 2.7679 HRD-in -83.92, -49.74 70.18, 5.0 in-in-out SNCiio in-out ActLoopNT-in 2.9085 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out -91.27, -0.22 APE9-dihe-in -61.31, 133.53 APE8-dihe-in -80.65, 66.28 APE8-rot-na 25.35 APE67-dihe-in -75.46, -3.05 -48.32, -34.38 APE12-dist-na 9.8871 APE11-dist-na 13.0203 APE10-dist-na 9.5149 APE9-dist-in 6.7075 C936A,Q969A,E971A,K972A,D1023N,C1142A None None XRAY 2.0 0.217 0.217 A 302.0 287.0 0 31 31 0 [[589, 868], [897, 1171]] 2.0 4gih TYR_TYK2-2_HUMAN TYR 3.6e-81 278.3 2.0 260.0 259.0 1040 1041 1042 1044 1046 930 947 951 1020 1022 1021 1023.0 1083 1071 1066 1065 1064 1063 1062 1061 1060 979 Non-receptor tyrosine-protein kinase TYK2

Ligand: 0X5

Total number of chains: 2
Active chains: 1
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 4GIHA
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 4GMYA O60674 833 1132 1132.0 0X5:1201 Type1 Active DFGin 6.3229 14.3677 BLAminus -129.14, -151.03 59.75, 56.19 -91.99, 15.7 291.11, 106.6 -64.82, -18.52 in-in in 8.6089 Saltbr-in 2.934 HRD-in -66.28, -44.86 75.83, -6.94 in-in-in SNCiii in-in ActLoopNT-in 2.7483 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.06, 153.62 APE9-dihe-in -126.47, 151.79 APE8-dihe-in -73.92, 63.65 APE8-rot-na 25.85 APE67-dihe-in -78.85, -1.67 -58.34, -29.64 APE12-dist-na 13.1569 APE11-dist-na 13.0705 APE10-dist-na 13.2143 APE9-dist-in 7.8755 None PTR1007,PTR1008 PTR1007,PTR1008 XRAY 2.403 0.167 0.233 A 302.0 300.0 0 31 31 0 [[545, 807], [849, 1125]] 2.0 4gmy Homo sapiens TYR_JAK2-2_HUMAN TYR 2.7e-87 298.3 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 TYK2-2 TYK2_HUMAN 4GIHA P29597 890 1176 1187.0 0X5:61201 Type1 Inactive DFGin 6.6069 13.9542 BLAminus -120.14, -171.23 42.64, 89.76 -99.46, 23.47 285.31, 88.12 -62.7, -22.0 in-in in 8.2325 Saltbr-in 2.7679 HRD-in -83.92, -49.74 70.18, 5.0 in-in-out SNCiio in-out ActLoopNT-in 2.9085 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out -91.27, -0.22 APE9-dihe-in -61.31, 133.53 APE8-dihe-in -80.65, 66.28 APE8-rot-na 25.35 APE67-dihe-in -75.46, -3.05 -48.32, -34.38 APE12-dist-na 9.8871 APE11-dist-na 13.0203 APE10-dist-na 9.5149 APE9-dist-in 6.7075 C936A,Q969A,E971A,K972A,D1023N,C1142A None None XRAY 2.0 0.217 0.217 A 302.0 287.0 0 31 31 0 [[589, 868], [897, 1171]] 2.0 4gih Homo sapiens TYR_TYK2-2_HUMAN TYR 3.6e-81 278.3 2.0 260.0 259.0 1040 1041 1042 1044 1046 930 947 951 1020 1022 1021 1023.0 1083 1071 1066 1065 1064 1063 1062 1061 1060 979 Non-receptor tyrosine-protein kinase TYK2

Ligand: 0X5

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