Ligand: VEU

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8TX0B
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
TKL IRAK4 IRAK4_HUMAN 8TX0A Q9NWZ3 164 459 460.0 VEU:501 Type1 Inactive DFGin 6.7893 13.9204 BLAminus -129.73, 176.59 65.6, 77.23 -99.3, 19.02 315.24, 98.72 -60.81, -34.53 in-out in 8.826 Saltbr-out 5.8696 HRD-in -69.7, -48.85 75.81, -2.36 out-in-in SNCoii in-in ActLoopNT-in 2.6468 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -128.63, 157.0 APE9-dihe-na 131.18, -179.13 APE8-dihe-in -106.66, 116.14 APE8-rot-in 293.2 APE67-dihe-in -65.42, -13.38 -58.15, -40.41 APE12-dist-in 9.8637 APE11-dist-in 11.8077 APE10-dist-in 6.5529 APE9-dist-in 4.2168 None TPO342,TPO345,SEP346 TPO342,TPO345,SEP346 XRAY 2.0 0.208 0.238 A 307.0 286.0 10 30 25 5 [[183, 456]] 1.0 8tx0 TKL_IRAK4_HUMAN TKL 4.4e-84 288.1 5.0 266.0 262.0 328 329 330 332 334 213 233 237 308 310 309 311.0 369 358 353 352 351 350 349 348 347 263 Interleukin-1 receptor-associated kinase 4
TKL IRAK4 IRAK4_HUMAN 8TX0B Q9NWZ3 164 459 460.0 VEU:501 Type1 Inactive DFGin 6.8379 14.2966 BLAminus -129.72, 178.54 65.66, 76.17 -98.39, 13.53 305.13, 94.22 -63.2, -26.14 in-out in 9.2869 Saltbr-out 4.5523 HRD-in -70.22, -48.33 73.47, 0.05 out-in-in SNCoii in-in ActLoopNT-in 2.7242 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.02, 152.76 APE9-dihe-na 138.77, -175.43 APE8-dihe-in -104.24, 111.09 APE8-rot-in 310.05 APE67-dihe-in -64.51, -18.26 -47.53, -45.01 APE12-dist-in 9.9994 APE11-dist-in 12.0054 APE10-dist-in 7.0902 APE9-dist-in 4.8138 None TPO342,TPO345,SEP346 TPO342,TPO345,SEP346 XRAY 2.0 0.208 0.238 B 307.0 292.0 4 30 26 4 [[183, 456]] 1.0 8tx0 TKL_IRAK4_HUMAN TKL 4.4e-84 288.1 5.0 266.0 262.0 328 329 330 332 334 213 233 237 308 310 309 311.0 369 358 353 352 351 350 349 348 347 263 Interleukin-1 receptor-associated kinase 4

Ligand: VEU

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8TX0B
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
TKL IRAK4 IRAK4_HUMAN 8TX0A Q9NWZ3 164 459 460.0 VEU:501 Type1 Inactive DFGin 6.7893 13.9204 BLAminus -129.73, 176.59 65.6, 77.23 -99.3, 19.02 315.24, 98.72 -60.81, -34.53 in-out in 8.826 Saltbr-out 5.8696 HRD-in -69.7, -48.85 75.81, -2.36 out-in-in SNCoii in-in ActLoopNT-in 2.6468 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -128.63, 157.0 APE9-dihe-na 131.18, -179.13 APE8-dihe-in -106.66, 116.14 APE8-rot-in 293.2 APE67-dihe-in -65.42, -13.38 -58.15, -40.41 APE12-dist-in 9.8637 APE11-dist-in 11.8077 APE10-dist-in 6.5529 APE9-dist-in 4.2168 None TPO342,TPO345,SEP346 TPO342,TPO345,SEP346 XRAY 2.0 0.208 0.238 A 307.0 286.0 10 30 25 5 [[183, 456]] 1.0 8tx0 Homo sapiens TKL_IRAK4_HUMAN TKL 4.4e-84 288.1 5.0 266.0 262.0 328 329 330 332 334 213 233 237 308 310 309 311.0 369 358 353 352 351 350 349 348 347 263 Interleukin-1 receptor-associated kinase 4
TKL IRAK4 IRAK4_HUMAN 8TX0B Q9NWZ3 164 459 460.0 VEU:501 Type1 Inactive DFGin 6.8379 14.2966 BLAminus -129.72, 178.54 65.66, 76.17 -98.39, 13.53 305.13, 94.22 -63.2, -26.14 in-out in 9.2869 Saltbr-out 4.5523 HRD-in -70.22, -48.33 73.47, 0.05 out-in-in SNCoii in-in ActLoopNT-in 2.7242 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.02, 152.76 APE9-dihe-na 138.77, -175.43 APE8-dihe-in -104.24, 111.09 APE8-rot-in 310.05 APE67-dihe-in -64.51, -18.26 -47.53, -45.01 APE12-dist-in 9.9994 APE11-dist-in 12.0054 APE10-dist-in 7.0902 APE9-dist-in 4.8138 None TPO342,TPO345,SEP346 TPO342,TPO345,SEP346 XRAY 2.0 0.208 0.238 B 307.0 292.0 4 30 26 4 [[183, 456]] 1.0 8tx0 Homo sapiens TKL_IRAK4_HUMAN TKL 4.4e-84 288.1 5.0 266.0 262.0 328 329 330 332 334 213 233 237 308 310 309 311.0 369 358 353 352 351 350 349 348 347 263 Interleukin-1 receptor-associated kinase 4

Ligand: VEU

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