Ligand: R7P

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 1 50.0% 6VQMA
DFGin BLAminus 1 50.0% 6VQMB
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 6VQMA Q07912 117 390 1038.0 R7P:401 Type1 Inactive DFGin 6.1676 13.4636 ABAminus -107.72, -37.34 -107.23, 139.71 -135.32, 26.09 306.21, 97.86 -71.9, -43.92 in-in in 8.5769 Saltbr-in 2.571 HRD-in -71.98, -51.6 65.1, 16.99 in-in-in SNCiii in-in ActLoopNT-in 2.996 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -78.12, 107.17 APE9-dihe-in -75.55, 154.5 APE8-dihe-in -75.48, 79.2 APE8-rot-na 33.66 APE67-dihe-in -66.81, -24.97 -59.46, -37.23 APE12-dist-na 13.5428 APE11-dist-na 8.2872 APE10-dist-na 10.8443 APE9-dist-in 6.5729 None None None XRAY 2.87 0.273 0.33 A 289.0 267.0 7 31 31 0 [[126, 387]] 1.0 6vqm TYR_TNK2_HUMAN TYR 8.8e-86 293.3 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 6VQMB Q07912 117 392 1038.0 R7P:401 Type1 Active DFGin 6.5869 13.5939 BLAminus -126.29, -176.9 60.12, 78.79 -101.99, 43.61 309.18, 96.93 -70.48, -42.01 in-in in 8.3539 Saltbr-in 2.7897 HRD-in -70.81, -44.97 67.08, 13.61 in-in-in SNCiii in-in ActLoopNT-in 3.0338 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -74.03, 107.88 APE9-dihe-in -69.66, 138.93 APE8-dihe-in -77.17, 95.23 APE8-rot-na 27.59 APE67-dihe-in -70.22, -21.82 -51.53, -42.79 APE12-dist-na 12.2631 APE11-dist-na 8.4205 APE10-dist-na 12.2009 APE9-dist-in 7.1911 None None None XRAY 2.87 0.273 0.33 B 289.0 267.0 9 31 31 0 [[126, 387]] 1.0 6vqm TYR_TNK2_HUMAN TYR 8.8e-86 293.3 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: R7P

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 1 50.0% 6VQMA
DFGin BLAminus 1 50.0% 6VQMB
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 6VQMA Q07912 117 390 1038.0 R7P:401 Type1 Inactive DFGin 6.1676 13.4636 ABAminus -107.72, -37.34 -107.23, 139.71 -135.32, 26.09 306.21, 97.86 -71.9, -43.92 in-in in 8.5769 Saltbr-in 2.571 HRD-in -71.98, -51.6 65.1, 16.99 in-in-in SNCiii in-in ActLoopNT-in 2.996 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -78.12, 107.17 APE9-dihe-in -75.55, 154.5 APE8-dihe-in -75.48, 79.2 APE8-rot-na 33.66 APE67-dihe-in -66.81, -24.97 -59.46, -37.23 APE12-dist-na 13.5428 APE11-dist-na 8.2872 APE10-dist-na 10.8443 APE9-dist-in 6.5729 None None None XRAY 2.87 0.273 0.33 A 289.0 267.0 7 31 31 0 [[126, 387]] 1.0 6vqm Homo sapiens TYR_TNK2_HUMAN TYR 8.8e-86 293.3 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 6VQMB Q07912 117 392 1038.0 R7P:401 Type1 Active DFGin 6.5869 13.5939 BLAminus -126.29, -176.9 60.12, 78.79 -101.99, 43.61 309.18, 96.93 -70.48, -42.01 in-in in 8.3539 Saltbr-in 2.7897 HRD-in -70.81, -44.97 67.08, 13.61 in-in-in SNCiii in-in ActLoopNT-in 3.0338 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -74.03, 107.88 APE9-dihe-in -69.66, 138.93 APE8-dihe-in -77.17, 95.23 APE8-rot-na 27.59 APE67-dihe-in -70.22, -21.82 -51.53, -42.79 APE12-dist-na 12.2631 APE11-dist-na 8.4205 APE10-dist-na 12.2009 APE9-dist-in 7.1911 None None None XRAY 2.87 0.273 0.33 B 289.0 267.0 9 31 31 0 [[126, 387]] 1.0 6vqm Homo sapiens TYR_TNK2_HUMAN TYR 8.8e-86 293.3 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: R7P

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