Ligand: 46A

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3O2MA
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
CMGC MAPK8 MK08_HUMAN 3O2MA P45983 7 364 427.0 46A:60701 Allosteric Active DFGin 6.41 14.2667 BLAminus -152.63, 162.08 80.49, 93.8 -114.77, 18.61 304.8, 107.67 -61.69, -39.94 in-in in 8.7422 Saltbr-in 2.6189 HRD-in -69.47, -52.78 72.9, -13.97 in-in-in SNCiii in-in ActLoopNT-in 2.7753 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -72.53, -31.31 APE9-dihe-na -91.45, 126.81 APE8-dihe-in -59.5, 135.65 APE8-rot-in 301.85 APE67-dihe-in -63.02, -13.15 -75.49, -27.8 APE12-dist-in 11.2068 APE11-dist-in 12.7825 APE10-dist-in 7.434 APE9-dist-in 5.5284 T183E,Y185E None None XRAY 2.7 0.233 0.266 A 370.0 358.0 0 27 27 0 [[26, 321]] 1.0 3o2m CMGC_MAPK8_HUMAN CMGC 1.6e-83 286.4 1.0 301.0 301.0 168 169 170 172 174 55 73 77 148 150 149 151.0 207 195 190 189 188 187 186 185 184 109 Mitogen-activated protein kinase 8
CMGC MAPK8 MK08_HUMAN 3O2MB P45983 7 364 427.0 46A:60701 Allosteric Active DFGin 6.4326 14.024 BLAminus -142.38, 178.22 61.31, 93.12 -105.38, 24.63 305.62, 107.49 -54.81, -31.65 in-in in 9.0593 Saltbr-in 2.7002 HRD-in -67.22, -47.31 66.21, -6.68 in-in-in SNCiii in-in ActLoopNT-in 2.9293 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -49.13, -35.19 APE9-dihe-na -86.25, 135.93 APE8-dihe-in -71.9, 130.6 APE8-rot-in 296.5 APE67-dihe-in -57.01, -19.27 -49.25, -52.93 APE12-dist-in 11.5641 APE11-dist-in 12.8788 APE10-dist-in 7.9595 APE9-dist-in 5.5407 T183E,Y185E None None XRAY 2.7 0.233 0.266 B 370.0 358.0 0 27 27 0 [[26, 321]] 1.0 3o2m CMGC_MAPK8_HUMAN CMGC 1.6e-83 286.4 1.0 301.0 301.0 168 169 170 172 174 55 73 77 148 150 149 151.0 207 195 190 189 188 187 186 185 184 109 Mitogen-activated protein kinase 8

Ligand: 46A

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3O2MA
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
CMGC MAPK8 MK08_HUMAN 3O2MA P45983 7 364 427.0 46A:60701 Allosteric Active DFGin 6.41 14.2667 BLAminus -152.63, 162.08 80.49, 93.8 -114.77, 18.61 304.8, 107.67 -61.69, -39.94 in-in in 8.7422 Saltbr-in 2.6189 HRD-in -69.47, -52.78 72.9, -13.97 in-in-in SNCiii in-in ActLoopNT-in 2.7753 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -72.53, -31.31 APE9-dihe-na -91.45, 126.81 APE8-dihe-in -59.5, 135.65 APE8-rot-in 301.85 APE67-dihe-in -63.02, -13.15 -75.49, -27.8 APE12-dist-in 11.2068 APE11-dist-in 12.7825 APE10-dist-in 7.434 APE9-dist-in 5.5284 T183E,Y185E None None XRAY 2.7 0.233 0.266 A 370.0 358.0 0 27 27 0 [[26, 321]] 1.0 3o2m Homo sapiens CMGC_MAPK8_HUMAN CMGC 1.6e-83 286.4 1.0 301.0 301.0 168 169 170 172 174 55 73 77 148 150 149 151.0 207 195 190 189 188 187 186 185 184 109 Mitogen-activated protein kinase 8
CMGC MAPK8 MK08_HUMAN 3O2MB P45983 7 364 427.0 46A:60701 Allosteric Active DFGin 6.4326 14.024 BLAminus -142.38, 178.22 61.31, 93.12 -105.38, 24.63 305.62, 107.49 -54.81, -31.65 in-in in 9.0593 Saltbr-in 2.7002 HRD-in -67.22, -47.31 66.21, -6.68 in-in-in SNCiii in-in ActLoopNT-in 2.9293 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -49.13, -35.19 APE9-dihe-na -86.25, 135.93 APE8-dihe-in -71.9, 130.6 APE8-rot-in 296.5 APE67-dihe-in -57.01, -19.27 -49.25, -52.93 APE12-dist-in 11.5641 APE11-dist-in 12.8788 APE10-dist-in 7.9595 APE9-dist-in 5.5407 T183E,Y185E None None XRAY 2.7 0.233 0.266 B 370.0 358.0 0 27 27 0 [[26, 321]] 1.0 3o2m Homo sapiens CMGC_MAPK8_HUMAN CMGC 1.6e-83 286.4 1.0 301.0 301.0 168 169 170 172 174 55 73 77 148 150 149 151.0 207 195 190 189 188 187 186 185 184 109 Mitogen-activated protein kinase 8

Ligand: 46A

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