Ligand: XQL

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% 8PAWB
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
STE STK4 STK4_HUMAN 8PAWA Q13043 23 298 487.0 XQL:402 Type1 Inactive DFGin 6.1277 15.9513 BLAminus -132.89, 169.15 64.34, 80.6 -92.47, 21.59 289.33, 87.55 -63.36, -23.01 in-out in 9.5601 Saltbr-out 6.3895 HRD-in -61.61, -52.12 76.78, -6.44 out-in-in SNCoii in-in ActLoopNT-in 2.8217 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -151.75, 155.95 APE9-dihe-na 130.96, -163.99 APE8-dihe-in -113.43, 120.76 APE8-rot-in 308.82 APE67-dihe-in -63.93, -24.08 -38.54, -50.4 APE12-dist-in 8.4532 APE11-dist-in 11.5934 APE10-dist-in 5.8892 APE9-dist-in 3.2303 None TPO177,TPO183 TPO177,TPO183 XRAY 2.14 0.196 0.226 A 312.0 272.0 4 28 28 0 [[30, 281]] 1.0 8paw STE_STK4_HUMAN STE 4.1e-102 346.9 2.0 257.0 256.0 166 167 168 170 172 59 73 77 146 148 147 149.0 206 194 189 188 187 186 185 184 183 103 Serine/threonine-protein kinase 4
STE STK4 STK4_HUMAN 8PAWB Q13043 14 299 487.0 XQL:1001 Type1 Inactive DFGin 6.0996 16.0525 BLAminus -133.09, 165.97 68.44, 85.21 -93.54, 27.55 289.93, 83.76 -58.28, -28.45 in-out in 9.9607 Saltbr-out 6.7309 HRD-in -63.01, -50.43 74.36, -2.79 out-in-in SNCoii in-in ActLoopNT-in 2.83 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -154.49, 153.86 APE9-dihe-na 139.8, -162.94 APE8-dihe-in -110.25, 117.0 APE8-rot-in 311.46 APE67-dihe-in -65.88, -22.98 -34.81, -50.8 APE12-dist-in 8.3614 APE11-dist-in 11.5719 APE10-dist-in 5.8687 APE9-dist-in 3.2992 None TPO177,TPO183 TPO177,TPO183 XRAY 2.14 0.196 0.226 B 312.0 285.0 1 28 28 0 [[30, 281]] 1.0 8paw STE_STK4_HUMAN STE 4.1e-102 346.9 2.0 257.0 256.0 166 167 168 170 172 59 73 77 146 148 147 149.0 206 194 189 188 187 186 185 184 183 103 Serine/threonine-protein kinase 4

Ligand: XQL

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% 8PAWB
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
STE STK4 STK4_HUMAN 8PAWA Q13043 23 298 487.0 XQL:402 Type1 Inactive DFGin 6.1277 15.9513 BLAminus -132.89, 169.15 64.34, 80.6 -92.47, 21.59 289.33, 87.55 -63.36, -23.01 in-out in 9.5601 Saltbr-out 6.3895 HRD-in -61.61, -52.12 76.78, -6.44 out-in-in SNCoii in-in ActLoopNT-in 2.8217 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -151.75, 155.95 APE9-dihe-na 130.96, -163.99 APE8-dihe-in -113.43, 120.76 APE8-rot-in 308.82 APE67-dihe-in -63.93, -24.08 -38.54, -50.4 APE12-dist-in 8.4532 APE11-dist-in 11.5934 APE10-dist-in 5.8892 APE9-dist-in 3.2303 None TPO177,TPO183 TPO177,TPO183 XRAY 2.14 0.196 0.226 A 312.0 272.0 4 28 28 0 [[30, 281]] 1.0 8paw Homo sapiens STE_STK4_HUMAN STE 4.1e-102 346.9 2.0 257.0 256.0 166 167 168 170 172 59 73 77 146 148 147 149.0 206 194 189 188 187 186 185 184 183 103 Serine/threonine-protein kinase 4
STE STK4 STK4_HUMAN 8PAWB Q13043 14 299 487.0 XQL:1001 Type1 Inactive DFGin 6.0996 16.0525 BLAminus -133.09, 165.97 68.44, 85.21 -93.54, 27.55 289.93, 83.76 -58.28, -28.45 in-out in 9.9607 Saltbr-out 6.7309 HRD-in -63.01, -50.43 74.36, -2.79 out-in-in SNCoii in-in ActLoopNT-in 2.83 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -154.49, 153.86 APE9-dihe-na 139.8, -162.94 APE8-dihe-in -110.25, 117.0 APE8-rot-in 311.46 APE67-dihe-in -65.88, -22.98 -34.81, -50.8 APE12-dist-in 8.3614 APE11-dist-in 11.5719 APE10-dist-in 5.8687 APE9-dist-in 3.2992 None TPO177,TPO183 TPO177,TPO183 XRAY 2.14 0.196 0.226 B 312.0 285.0 1 28 28 0 [[30, 281]] 1.0 8paw Homo sapiens STE_STK4_HUMAN STE 4.1e-102 346.9 2.0 257.0 256.0 166 167 168 170 172 59 73 77 146 148 147 149.0 206 194 189 188 187 186 185 184 183 103 Serine/threonine-protein kinase 4

Ligand: XQL

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