Ligand: T95

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% 3EQPA
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 TNK2 ACK1_HUMAN 3EQPA Q07912 117 390 1038.0 T95:1 Type1 Inactive DFGin 6.7129 14.0036 BLAminus -122.28, -169.39 49.91, 85.82 -103.52, 29.12 298.07, 93.89 -65.88, -22.57 in-in in 8.5579 Saltbr-in 2.5574 HRD-in -67.58, -47.8 79.03, -3.11 in-in-out SNCiio in-out ActLoopNT-in 2.9373 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 41.47, 68.24 APE9-dihe-in -80.12, 152.64 APE8-dihe-in -67.7, 101.83 APE8-rot-na 335.05 APE67-dihe-in -66.98, -8.09 -37.76, -57.12 APE12-dist-na 12.432 APE11-dist-na 7.613 APE10-dist-na 11.6899 APE9-dist-in 6.3009 None None None XRAY 2.3 0.224 0.284 A 276.0 268.0 6 31 31 0 [[126, 387]] 1.0 3eqp TYR_TNK2_HUMAN TYR 7.4e-86 293.6 1.0 259.0 259.0 269 270 271 273 275 158 177 181 249 251 250 252.0 312 300 295 294 293 292 291 290 289 206 Activated CDC42 kinase 1
TYR TNK2 ACK1_HUMAN 3EQPB Q07912 117 392 1038.0 T95:1 Type1 Inactive DFGin 6.7469 13.9414 BLAminus -134.99, 176.53 61.95, 90.21 -110.2, 23.83 297.71, 92.68 -58.95, -17.74 in-in in 8.4225 Saltbr-in 2.5793 HRD-in -73.01, -48.54 76.03, -4.13 in-in-out SNCiio in-out ActLoopNT-in 2.816 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 48.1, 56.77 APE9-dihe-in -72.7, 143.2 APE8-dihe-in -64.45, 112.29 APE8-rot-na 344.7 APE67-dihe-in -74.41, -9.69 -53.7, -41.09 APE12-dist-na 12.3732 APE11-dist-na 7.5143 APE10-dist-na 11.7317 APE9-dist-in 6.1729 None None None XRAY 2.3 0.224 0.284 B 276.0 270.0 6 31 31 0 [[126, 387]] 1.0 3eqp TYR_TNK2_HUMAN TYR 7.4e-86 293.6 1.0 259.0 259.0 269 270 271 273 275 158 177 181 249 251 250 252.0 312 300 295 294 293 292 291 290 289 206 Activated CDC42 kinase 1

Ligand: T95

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% 3EQPA
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 TNK2 ACK1_HUMAN 3EQPA Q07912 117 390 1038.0 T95:1 Type1 Inactive DFGin 6.7129 14.0036 BLAminus -122.28, -169.39 49.91, 85.82 -103.52, 29.12 298.07, 93.89 -65.88, -22.57 in-in in 8.5579 Saltbr-in 2.5574 HRD-in -67.58, -47.8 79.03, -3.11 in-in-out SNCiio in-out ActLoopNT-in 2.9373 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 41.47, 68.24 APE9-dihe-in -80.12, 152.64 APE8-dihe-in -67.7, 101.83 APE8-rot-na 335.05 APE67-dihe-in -66.98, -8.09 -37.76, -57.12 APE12-dist-na 12.432 APE11-dist-na 7.613 APE10-dist-na 11.6899 APE9-dist-in 6.3009 None None None XRAY 2.3 0.224 0.284 A 276.0 268.0 6 31 31 0 [[126, 387]] 1.0 3eqp Homo sapiens TYR_TNK2_HUMAN TYR 7.4e-86 293.6 1.0 259.0 259.0 269 270 271 273 275 158 177 181 249 251 250 252.0 312 300 295 294 293 292 291 290 289 206 Activated CDC42 kinase 1
TYR TNK2 ACK1_HUMAN 3EQPB Q07912 117 392 1038.0 T95:1 Type1 Inactive DFGin 6.7469 13.9414 BLAminus -134.99, 176.53 61.95, 90.21 -110.2, 23.83 297.71, 92.68 -58.95, -17.74 in-in in 8.4225 Saltbr-in 2.5793 HRD-in -73.01, -48.54 76.03, -4.13 in-in-out SNCiio in-out ActLoopNT-in 2.816 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaai APE10-dihe-out 48.1, 56.77 APE9-dihe-in -72.7, 143.2 APE8-dihe-in -64.45, 112.29 APE8-rot-na 344.7 APE67-dihe-in -74.41, -9.69 -53.7, -41.09 APE12-dist-na 12.3732 APE11-dist-na 7.5143 APE10-dist-na 11.7317 APE9-dist-in 6.1729 None None None XRAY 2.3 0.224 0.284 B 276.0 270.0 6 31 31 0 [[126, 387]] 1.0 3eqp Homo sapiens TYR_TNK2_HUMAN TYR 7.4e-86 293.6 1.0 259.0 259.0 269 270 271 273 275 158 177 181 249 251 250 252.0 312 300 295 294 293 292 291 290 289 206 Activated CDC42 kinase 1

Ligand: T95

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