Ligand: 6QX

Total number of chains: 4
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 5K75C
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 5K75A Q9NWZ3 164 458 460.0 6QX:501 Type1 Active DFGin 6.9609 14.4664 BLAminus -129.66, 172.88 64.37, 85.54 -104.02, 19.65 309.39, 101.24 -65.12, -32.34 in-in in 8.9961 Saltbr-in 3.3638 HRD-in -66.74, -50.79 80.27, -9.49 in-in-in SNCiii in-in ActLoopNT-in 2.8428 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -125.74, 147.16 APE9-dihe-na 138.19, -172.64 APE8-dihe-in -106.01, 110.67 APE8-rot-in 312.95 APE67-dihe-in -63.15, -20.46 -40.66, -48.43 APE12-dist-in 10.1694 APE11-dist-in 11.8969 APE10-dist-in 6.4602 APE9-dist-in 4.0576 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 A 301.0 273.0 22 30 22 8 [[183, 456]] 1.0 5k75 TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75B Q9NWZ3 163 458 460.0 6QX:504 Type1 Inactive DFGin 6.9421 14.4597 BLAminus -128.01, 170.74 65.21, 84.11 -102.46, 21.31 309.47, 102.25 -65.48, -35.7 in-out in 8.9911 Saltbr-out 4.824 HRD-in -67.05, -49.26 79.32, -10.55 out-in-in SNCoii in-in ActLoopNT-in 2.8439 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -117.97, 151.22 APE9-dihe-na 136.05, -171.59 APE8-dihe-in -107.24, 112.63 APE8-rot-in 315.34 APE67-dihe-in -64.6, -19.05 -39.76, -49.9 APE12-dist-in 10.3108 APE11-dist-in 11.9727 APE10-dist-in 6.4513 APE9-dist-in 3.9883 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 B 301.0 276.0 20 30 24 6 [[183, 456]] 1.0 5k75 TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75C Q9NWZ3 164 458 460.0 6QX:503 Type1 Inactive DFGin 6.8715 14.6093 BLAminus -129.83, 165.29 65.74, 85.81 -102.99, 19.43 308.09, 104.56 -63.96, -32.44 in-out in 9.2956 Saltbr-out 5.3423 HRD-in -68.14, -49.27 78.52, -10.11 out-in-in SNCoii in-in ActLoopNT-in 2.8545 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -124.89, 149.58 APE9-dihe-na 136.24, -173.39 APE8-dihe-in -107.03, 113.02 APE8-rot-in 310.39 APE67-dihe-in -64.46, -18.84 -41.97, -48.83 APE12-dist-in 10.2092 APE11-dist-in 11.9086 APE10-dist-in 6.4163 APE9-dist-in 3.9225 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 C 301.0 284.0 11 30 24 6 [[183, 456]] 1.0 5k75 TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75D Q9NWZ3 164 458 460.0 6QX:503 Type1 Inactive DFGin 6.8707 14.653 BLAminus -129.48, 170.81 65.18, 85.95 -104.57, 20.05 308.12, 102.19 -64.37, -31.42 in-out in 9.3321 Saltbr-out 6.1167 HRD-in -68.05, -50.39 79.24, -8.5 out-in-in SNCoii in-in ActLoopNT-in 2.8485 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.04, 148.95 APE9-dihe-na 137.45, -171.0 APE8-dihe-in -108.28, 111.67 APE8-rot-in 312.02 APE67-dihe-in -64.11, -18.6 -47.87, -42.01 APE12-dist-in 10.0957 APE11-dist-in 11.8943 APE10-dist-in 6.4432 APE9-dist-in 4.0163 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 D 301.0 282.0 13 30 25 5 [[183, 456]] 1.0 5k75 TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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: 6QX

Total number of chains: 4
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 5K75C
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 5K75A Q9NWZ3 164 458 460.0 6QX:501 Type1 Active DFGin 6.9609 14.4664 BLAminus -129.66, 172.88 64.37, 85.54 -104.02, 19.65 309.39, 101.24 -65.12, -32.34 in-in in 8.9961 Saltbr-in 3.3638 HRD-in -66.74, -50.79 80.27, -9.49 in-in-in SNCiii in-in ActLoopNT-in 2.8428 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -125.74, 147.16 APE9-dihe-na 138.19, -172.64 APE8-dihe-in -106.01, 110.67 APE8-rot-in 312.95 APE67-dihe-in -63.15, -20.46 -40.66, -48.43 APE12-dist-in 10.1694 APE11-dist-in 11.8969 APE10-dist-in 6.4602 APE9-dist-in 4.0576 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 A 301.0 273.0 22 30 22 8 [[183, 456]] 1.0 5k75 Homo sapiens TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75B Q9NWZ3 163 458 460.0 6QX:504 Type1 Inactive DFGin 6.9421 14.4597 BLAminus -128.01, 170.74 65.21, 84.11 -102.46, 21.31 309.47, 102.25 -65.48, -35.7 in-out in 8.9911 Saltbr-out 4.824 HRD-in -67.05, -49.26 79.32, -10.55 out-in-in SNCoii in-in ActLoopNT-in 2.8439 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -117.97, 151.22 APE9-dihe-na 136.05, -171.59 APE8-dihe-in -107.24, 112.63 APE8-rot-in 315.34 APE67-dihe-in -64.6, -19.05 -39.76, -49.9 APE12-dist-in 10.3108 APE11-dist-in 11.9727 APE10-dist-in 6.4513 APE9-dist-in 3.9883 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 B 301.0 276.0 20 30 24 6 [[183, 456]] 1.0 5k75 Homo sapiens TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75C Q9NWZ3 164 458 460.0 6QX:503 Type1 Inactive DFGin 6.8715 14.6093 BLAminus -129.83, 165.29 65.74, 85.81 -102.99, 19.43 308.09, 104.56 -63.96, -32.44 in-out in 9.2956 Saltbr-out 5.3423 HRD-in -68.14, -49.27 78.52, -10.11 out-in-in SNCoii in-in ActLoopNT-in 2.8545 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -124.89, 149.58 APE9-dihe-na 136.24, -173.39 APE8-dihe-in -107.03, 113.02 APE8-rot-in 310.39 APE67-dihe-in -64.46, -18.84 -41.97, -48.83 APE12-dist-in 10.2092 APE11-dist-in 11.9086 APE10-dist-in 6.4163 APE9-dist-in 3.9225 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 C 301.0 284.0 11 30 24 6 [[183, 456]] 1.0 5k75 Homo sapiens TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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 5K75D Q9NWZ3 164 458 460.0 6QX:503 Type1 Inactive DFGin 6.8707 14.653 BLAminus -129.48, 170.81 65.18, 85.95 -104.57, 20.05 308.12, 102.19 -64.37, -31.42 in-out in 9.3321 Saltbr-out 6.1167 HRD-in -68.05, -50.39 79.24, -8.5 out-in-in SNCoii in-in ActLoopNT-in 2.8485 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.04, 148.95 APE9-dihe-na 137.45, -171.0 APE8-dihe-in -108.28, 111.67 APE8-rot-in 312.02 APE67-dihe-in -64.11, -18.6 -47.87, -42.01 APE12-dist-in 10.0957 APE11-dist-in 11.8943 APE10-dist-in 6.4432 APE9-dist-in 4.0163 None TPO345,SEP346 TPO345,SEP346 XRAY 2.03 0.24 0.253 D 301.0 282.0 13 30 25 5 [[183, 456]] 1.0 5k75 Homo sapiens TKL_IRAK4_HUMAN TKL 4.1e-84 288.2 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: 6QX

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