Ligand: KEJ

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% 6N77A
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 JAK1-2 JAK1_HUMAN 6N77A P23458 866 1154 1154.0 KEJ:1201 Type1 Inactive DFGin 6.3905 13.6543 ABAminus -111.17, 5.93 -155.03, 145.91 -137.7, 32.01 295.16, 86.03 -58.79, -28.87 in-in in 8.2385 Saltbr-in 2.7578 HRD-in -67.03, -46.69 67.69, -1.58 in-in-out SNCiio in-out ActLoopNT-in 2.9237 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 52.82, 53.92 APE9-dihe-in -90.09, 140.83 APE8-dihe-in -78.25, 71.6 APE8-rot-na 26.8 APE67-dihe-in -76.7, -1.13 -52.74, -34.15 APE12-dist-na 11.0789 APE11-dist-na 12.0899 APE10-dist-na 10.9937 APE9-dist-in 7.0193 None PTR1034,PTR1035 PTR1034,PTR1035 XRAY 1.64 0.253 0.282 A 302.0 280.0 9 31 31 0 [[583, 847], [875, 1151]] 2.0 6n77 TYR_JAK1-2_HUMAN TYR 2.2e-87 298.6 2.0 259.0 258.0 1020 1021 1022 1024 1026 908 925 929 1000 1002 1001 1003.0 1063 1051 1046 1045 1044 1043 1042 1041 1040 957 Tyrosine-protein kinase JAK1
TYR JAK1-2 JAK1_HUMAN 6N77B P23458 865 1154 1154.0 KEJ:1202 Type1 Inactive DFGin 6.4472 13.754 ABAminus -112.96, 6.51 -156.54, 142.84 -135.02, 28.22 296.71, 89.38 -58.72, -26.41 in-in in 8.2129 Saltbr-in 2.7371 HRD-in -67.03, -48.62 72.63, -6.63 in-in-out SNCiio in-out ActLoopNT-in 2.8443 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out -102.58, 44.0 APE9-dihe-in -74.12, 131.71 APE8-dihe-in -79.78, 70.31 APE8-rot-na 28.35 APE67-dihe-in -75.35, -3.65 -48.14, -35.74 APE12-dist-na 10.9335 APE11-dist-na 12.6892 APE10-dist-na 9.9871 APE9-dist-in 6.9541 None PTR1034,PTR1035 PTR1034,PTR1035 XRAY 1.64 0.253 0.282 B 302.0 279.0 11 31 31 0 [[583, 847], [875, 1151]] 2.0 6n77 TYR_JAK1-2_HUMAN TYR 2.2e-87 298.6 2.0 259.0 258.0 1020 1021 1022 1024 1026 908 925 929 1000 1002 1001 1003.0 1063 1051 1046 1045 1044 1043 1042 1041 1040 957 Tyrosine-protein kinase JAK1

Ligand: KEJ

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% 6N77A
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 JAK1-2 JAK1_HUMAN 6N77A P23458 866 1154 1154.0 KEJ:1201 Type1 Inactive DFGin 6.3905 13.6543 ABAminus -111.17, 5.93 -155.03, 145.91 -137.7, 32.01 295.16, 86.03 -58.79, -28.87 in-in in 8.2385 Saltbr-in 2.7578 HRD-in -67.03, -46.69 67.69, -1.58 in-in-out SNCiio in-out ActLoopNT-in 2.9237 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 52.82, 53.92 APE9-dihe-in -90.09, 140.83 APE8-dihe-in -78.25, 71.6 APE8-rot-na 26.8 APE67-dihe-in -76.7, -1.13 -52.74, -34.15 APE12-dist-na 11.0789 APE11-dist-na 12.0899 APE10-dist-na 10.9937 APE9-dist-in 7.0193 None PTR1034,PTR1035 PTR1034,PTR1035 XRAY 1.64 0.253 0.282 A 302.0 280.0 9 31 31 0 [[583, 847], [875, 1151]] 2.0 6n77 Homo sapiens TYR_JAK1-2_HUMAN TYR 2.2e-87 298.6 2.0 259.0 258.0 1020 1021 1022 1024 1026 908 925 929 1000 1002 1001 1003.0 1063 1051 1046 1045 1044 1043 1042 1041 1040 957 Tyrosine-protein kinase JAK1
TYR JAK1-2 JAK1_HUMAN 6N77B P23458 865 1154 1154.0 KEJ:1202 Type1 Inactive DFGin 6.4472 13.754 ABAminus -112.96, 6.51 -156.54, 142.84 -135.02, 28.22 296.71, 89.38 -58.72, -26.41 in-in in 8.2129 Saltbr-in 2.7371 HRD-in -67.03, -48.62 72.63, -6.63 in-in-out SNCiio in-out ActLoopNT-in 2.8443 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out -102.58, 44.0 APE9-dihe-in -74.12, 131.71 APE8-dihe-in -79.78, 70.31 APE8-rot-na 28.35 APE67-dihe-in -75.35, -3.65 -48.14, -35.74 APE12-dist-na 10.9335 APE11-dist-na 12.6892 APE10-dist-na 9.9871 APE9-dist-in 6.9541 None PTR1034,PTR1035 PTR1034,PTR1035 XRAY 1.64 0.253 0.282 B 302.0 279.0 11 31 31 0 [[583, 847], [875, 1151]] 2.0 6n77 Homo sapiens TYR_JAK1-2_HUMAN TYR 2.2e-87 298.6 2.0 259.0 258.0 1020 1021 1022 1024 1026 908 925 929 1000 1002 1001 1003.0 1063 1051 1046 1045 1044 1043 1042 1041 1040 957 Tyrosine-protein kinase JAK1

Ligand: KEJ

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