Ligand: 6GY (Brigatinib, Alunbrig)

Total number of chains: 4
Active chains: 3
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 75.0% 8H7XA
DFGin ABAminus 1 25.0% 6MX8A
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 ALK ALK_HUMAN 6MX8A Q9UM73 1094 1400 1620.0 6GY:1500 Type1 Inactive DFGin 6.142 14.662 ABAminus -114.12, -38.77 -118.14, 138.18 -129.19, 26.62 289.5, 87.05 -61.73, -41.9 in-in in 7.786 Saltbr-in 3.234 HRD-in -72.93, -50.14 84.31, -4.9 in-none-out SNCino none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -101.89, -3.2 APE9-dihe-in -73.94, 138.53 APE8-dihe-in -85.7, 68.86 APE8-rot-na 37.09 APE67-dihe-in -74.13, -8.15 -48.67, -39.52 APE12-dist-na 14.244 APE11-dist-na 15.184 APE10-dist-na 10.084 APE9-dist-out 8.168 None None None XRAY 1.96 0.185 0.227 A 307 282 25 0 0 13 [[1116, 1385]] 1.0 6mx8 TYR_ALK_HUMAN TYR 1.1e-90 309.4 1 260 260 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor
TYR EGFR EGFR_HUMAN 8H7XA P00533 697 1019 1210.0 6GY:1500 Type1 Active DFGin 5.635 13.772 BLAminus -162.89, 168.84 77.21, 81.71 -97.92, 23.57 309.06, 76.3 -58.42, -31.29 in-in in 8.899 Saltbr-in 3.163 HRD-in -78.19, -35.41 64.93, 5.25 in-in-in SNCiii in-in ActLoopNT-in 3.032 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -124.33, 109.95 APE9-dihe-in -128.71, 142.43 APE8-dihe-in -73.85, 112.86 APE8-rot-na 33.56 APE67-dihe-in -80.76, -11.68 -63.25, -24.22 APE12-dist-na 12.291 APE11-dist-na 9.112 APE10-dist-na 10.289 APE9-dist-in 6.269 T790M,C797S None None XRAY 3.404 0.189 0.256 A 330 299 0 0 0 0 [[712, 970]] 1.0 8h7x TYR_EGFR_HUMAN TYR 6.2e-88 300.5 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 7ZYMA P00533 696 1020 1210.0 6GY:1101 Type1 Active DFGin 6.105 14.6 BLAminus -125.58, -171.05 53.24, 83.12 -97.68, 28.42 294.56, 85.3 -63.28, -32.0 in-in in 8.44 Saltbr-in 2.735 HRD-in -69.53, -46.77 68.71, 4.77 in-in-in SNCiii in-in ActLoopNT-in 3.0 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -101.21, 113.9 APE9-dihe-in -126.31, 139.74 APE8-dihe-in -66.94, 111.98 APE8-rot-na 339.42 APE67-dihe-in -73.89, -7.64 -66.97, -37.27 APE12-dist-na 12.195 APE11-dist-na 9.561 APE10-dist-na 10.212 APE9-dist-in 6.152 T790M,C797S,E865A,E866A,K867A None None XRAY 2.5 0.194 0.224 A 333 321 4 0 0 0 [[712, 970]] 1.0 7zym TYR_EGFR_HUMAN TYR 3.4e-87 298.1 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 7AEMA P00533 695 1018 1210.0 6GY:1101 Type1 Active DFGin 6.131 14.377 BLAminus -127.32, -173.27 58.22, 82.35 -96.27, 28.52 299.39, 108.91 -62.1, -37.1 in-in in 8.638 Saltbr-in 2.804 HRD-in -54.09, -43.45 61.95, 3.78 in-in-in SNCiii in-in ActLoopNT-in 3.047 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -73.52, 113.41 APE9-dihe-in -117.42, 140.01 APE8-dihe-in -72.37, 110.57 APE8-rot-na 353.82 APE67-dihe-in -65.05, -21.43 -66.41, -39.04 APE12-dist-na 12.28 APE11-dist-na 9.798 APE10-dist-na 10.67 APE9-dist-in 6.31 None None None XRAY 2.65 0.199 0.221 A 346 312 2 0 0 0 [[712, 970]] 1.0 7aem TYR_EGFR_HUMAN TYR 1.3e-87 299.5 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor

Ligand: 6GY (Brigatinib, Alunbrig)

Total number of chains: 4
Active chains: 3
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 75.0% 8H7XA
DFGin ABAminus 1 25.0% 6MX8A
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 ALK ALK_HUMAN 6MX8A Q9UM73 1094 1400 1620.0 6GY:1500 Type1 Inactive DFGin 6.142 14.662 ABAminus -114.12, -38.77 -118.14, 138.18 -129.19, 26.62 289.5, 87.05 -61.73, -41.9 in-in in 7.786 Saltbr-in 3.234 HRD-in -72.93, -50.14 84.31, -4.9 in-none-out SNCino none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -101.89, -3.2 APE9-dihe-in -73.94, 138.53 APE8-dihe-in -85.7, 68.86 APE8-rot-na 37.09 APE67-dihe-in -74.13, -8.15 -48.67, -39.52 APE12-dist-na 14.244 APE11-dist-na 15.184 APE10-dist-na 10.084 APE9-dist-out 8.168 None None None XRAY 1.96 0.185 0.227 A 307 282 25 0 0 13 [[1116, 1385]] 1.0 6mx8 Homo sapiens TYR_ALK_HUMAN TYR 1.1e-90 309.4 1 260 260 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor
TYR EGFR EGFR_HUMAN 8H7XA P00533 697 1019 1210.0 6GY:1500 Type1 Active DFGin 5.635 13.772 BLAminus -162.89, 168.84 77.21, 81.71 -97.92, 23.57 309.06, 76.3 -58.42, -31.29 in-in in 8.899 Saltbr-in 3.163 HRD-in -78.19, -35.41 64.93, 5.25 in-in-in SNCiii in-in ActLoopNT-in 3.032 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -124.33, 109.95 APE9-dihe-in -128.71, 142.43 APE8-dihe-in -73.85, 112.86 APE8-rot-na 33.56 APE67-dihe-in -80.76, -11.68 -63.25, -24.22 APE12-dist-na 12.291 APE11-dist-na 9.112 APE10-dist-na 10.289 APE9-dist-in 6.269 T790M,C797S None None XRAY 3.404 0.189 0.256 A 330 299 0 0 0 0 [[712, 970]] 1.0 8h7x Homo sapiens TYR_EGFR_HUMAN TYR 6.2e-88 300.5 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 7ZYMA P00533 696 1020 1210.0 6GY:1101 Type1 Active DFGin 6.105 14.6 BLAminus -125.58, -171.05 53.24, 83.12 -97.68, 28.42 294.56, 85.3 -63.28, -32.0 in-in in 8.44 Saltbr-in 2.735 HRD-in -69.53, -46.77 68.71, 4.77 in-in-in SNCiii in-in ActLoopNT-in 3.0 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -101.21, 113.9 APE9-dihe-in -126.31, 139.74 APE8-dihe-in -66.94, 111.98 APE8-rot-na 339.42 APE67-dihe-in -73.89, -7.64 -66.97, -37.27 APE12-dist-na 12.195 APE11-dist-na 9.561 APE10-dist-na 10.212 APE9-dist-in 6.152 T790M,C797S,E865A,E866A,K867A None None XRAY 2.5 0.194 0.224 A 333 321 4 0 0 0 [[712, 970]] 1.0 7zym Homo sapiens TYR_EGFR_HUMAN TYR 3.4e-87 298.1 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 7AEMA P00533 695 1018 1210.0 6GY:1101 Type1 Active DFGin 6.131 14.377 BLAminus -127.32, -173.27 58.22, 82.35 -96.27, 28.52 299.39, 108.91 -62.1, -37.1 in-in in 8.638 Saltbr-in 2.804 HRD-in -54.09, -43.45 61.95, 3.78 in-in-in SNCiii in-in ActLoopNT-in 3.047 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -73.52, 113.41 APE9-dihe-in -117.42, 140.01 APE8-dihe-in -72.37, 110.57 APE8-rot-na 353.82 APE67-dihe-in -65.05, -21.43 -66.41, -39.04 APE12-dist-na 12.28 APE11-dist-na 9.798 APE10-dist-na 10.67 APE9-dist-in 6.31 None None None XRAY 2.65 0.199 0.221 A 346 312 2 0 0 0 [[712, 970]] 1.0 7aem Homo sapiens TYR_EGFR_HUMAN TYR 1.3e-87 299.5 3 259 257 854 855 856 858 860 745 762 766 834 836 835 837 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor

Ligand: 6GY (Brigatinib, Alunbrig)

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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