Ligand: 3U9

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% 4CNHB
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 ALK ALK_HUMAN 4CNHA Q9UM73 1094 1402 1620.0 3U9:2402 Type1 Inactive DFGin 6.3283 15.0458 ABAminus -121.41, -13.5 -134.76, 134.27 -127.13, 24.83 291.86, 80.94 -58.37, -37.06 in-out in 7.9054 Saltbr-out 4.9159 HRD-in -72.36, -47.54 81.36, -5.81 out-out-none SNCoon out-none ActLoopNT-out 7.0247 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 36.87 APE9-dihe-in -64.44, 124.84 APE8-dihe-in -71.68, 78.76 APE8-rot-na 25.36 APE67-dihe-in -71.29, -8.43 -50.25, -44.65 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 7.445 APE9-dist-in 6.8106 None None None XRAY 1.9 0.206 0.25 A 327.0 286.0 23 30 20 10 [[1116, 1385]] 1.0 4cnh TYR_ALK_HUMAN TYR 1.4e-90 309.1 1.0 260.0 260.0 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249.0 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor
TYR ALK ALK_HUMAN 4CNHB Q9UM73 1093 1401 1620.0 3U9:2401,3U9:2402 Type1,Allosteric Inactive DFGin 4.3394 12.3272 ABAminus -115.59, -14.06 -164.87, 163.73 -86.41, -10.43 302.46, 115.44 53.37, -130.64 in-in in 8.0724 Saltbr-in 2.6288 HRD-in -84.33, -49.79 83.6, -11.29 in-out-out SNCioo out-out ActLoopNT-out 8.5492 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -91.6, -17.34 APE9-dihe-in -73.51, 138.4 APE8-dihe-in -77.48, 68.43 APE8-rot-na 27.84 APE67-dihe-in -66.22, -13.37 -69.94, -19.9 APE12-dist-na 12.7837 APE11-dist-na 13.4643 APE10-dist-na 8.3849 APE9-dist-out 8.684 None None None XRAY 1.9 0.206 0.25 B 327.0 294.0 15 30 25 5 [[1116, 1385]] 1.0 4cnh TYR_ALK_HUMAN TYR 1.4e-90 309.1 1.0 260.0 260.0 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249.0 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor

Ligand: 3U9

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% 4CNHB
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 ALK ALK_HUMAN 4CNHA Q9UM73 1094 1402 1620.0 3U9:2402 Type1 Inactive DFGin 6.3283 15.0458 ABAminus -121.41, -13.5 -134.76, 134.27 -127.13, 24.83 291.86, 80.94 -58.37, -37.06 in-out in 7.9054 Saltbr-out 4.9159 HRD-in -72.36, -47.54 81.36, -5.81 out-out-none SNCoon out-none ActLoopNT-out 7.0247 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 36.87 APE9-dihe-in -64.44, 124.84 APE8-dihe-in -71.68, 78.76 APE8-rot-na 25.36 APE67-dihe-in -71.29, -8.43 -50.25, -44.65 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 7.445 APE9-dist-in 6.8106 None None None XRAY 1.9 0.206 0.25 A 327.0 286.0 23 30 20 10 [[1116, 1385]] 1.0 4cnh Homo sapiens TYR_ALK_HUMAN TYR 1.4e-90 309.1 1.0 260.0 260.0 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249.0 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor
TYR ALK ALK_HUMAN 4CNHB Q9UM73 1093 1401 1620.0 3U9:2401,3U9:2402 Type1,Allosteric Inactive DFGin 4.3394 12.3272 ABAminus -115.59, -14.06 -164.87, 163.73 -86.41, -10.43 302.46, 115.44 53.37, -130.64 in-in in 8.0724 Saltbr-in 2.6288 HRD-in -84.33, -49.79 83.6, -11.29 in-out-out SNCioo out-out ActLoopNT-out 8.5492 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -91.6, -17.34 APE9-dihe-in -73.51, 138.4 APE8-dihe-in -77.48, 68.43 APE8-rot-na 27.84 APE67-dihe-in -66.22, -13.37 -69.94, -19.9 APE12-dist-na 12.7837 APE11-dist-na 13.4643 APE10-dist-na 8.3849 APE9-dist-out 8.684 None None None XRAY 1.9 0.206 0.25 B 327.0 294.0 15 30 25 5 [[1116, 1385]] 1.0 4cnh Homo sapiens TYR_ALK_HUMAN TYR 1.4e-90 309.1 1.0 260.0 260.0 1269 1270 1271 1273 1275 1150 1167 1171 1246 1248 1247 1249.0 1311 1299 1294 1293 1292 1291 1290 1289 1288 1197 ALK tyrosine kinase receptor

Ligand: 3U9

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