Ligand: A1AWV

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 1 50.0% 9CJ3A
DFGout None 1 50.0% 9CJ5A
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 MAPK14 MK14_HUMAN 9CJ3A Q16539 4 352 360.0 PDO:408,A1AWV:410 Allosteric,Type2 Inactive DFGout 15.2727 9.3064 BBAminus -138.7, -172.72 -146.54, 104.28 -50.46, -45.96 262.7, 81.94 68.22, 25.32 in-in in 8.4984 Saltbr-in 2.8294 HRD-in -69.96, -52.7 76.88, -14.52 in-out-out SNCioo out-out ActLoopNT-out 16.5343 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_oioo APE10-dihe-na -126.47, 117.16 APE9-dihe-na -77.09, 129.32 APE8-dihe-out -52.48, -42.5 APE8-rot-in 292.76 APE67-dihe-in -62.21, -22.05 -58.1, -28.96 APE12-dist-out 14.7632 APE11-dist-in 12.8512 APE10-dist-out 12.7487 APE9-dist-out 10.3175 None TPO180,PTR182 TPO180,PTR182 XRAY 1.95 0.144 0.189 A 360.0 344.0 5 25 20 5 [[24, 308]] 1.0 9cj3 CMGC_MAPK14_HUMAN CMGC 5.9e-85 291.1 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_HUMAN 9CJ5A Q16539 5 352 360.0 A1AWV:404,PDO:405 Type2,Allosteric Inactive DFGout 15.6037 9.9462 None -161.07, 167.42 -158.02, 105.92 -133.23, 63.25 67.22, 124.33 -54.97, -26.0 in-in in 8.6967 Saltbr-in 2.7666 HRD-in -81.64, -51.08 76.49, -58.0 in-none-out SNCino none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nooo APE10-dihe-na -113.44, 119.12 APE9-dihe-na -66.71, 142.75 APE8-dihe-out -74.59, -35.87 APE8-rot-in 303.87 APE67-dihe-in -57.3, -25.76 -59.56, -25.3 APE12-dist-none 999.0 APE11-dist-out 14.2449 APE10-dist-out 15.0331 APE9-dist-out 11.8063 None None None XRAY 3.3 0.247 0.276 A 360.0 334.0 11 25 19 6 [[24, 308]] 1.0 9cj5 CMGC_MAPK14_HUMAN CMGC 5.9e-85 291.1 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14

Ligand: A1AWV

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 1 50.0% 9CJ3A
DFGout None 1 50.0% 9CJ5A
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 MAPK14 MK14_HUMAN 9CJ3A Q16539 4 352 360.0 PDO:408,A1AWV:410 Allosteric,Type2 Inactive DFGout 15.2727 9.3064 BBAminus -138.7, -172.72 -146.54, 104.28 -50.46, -45.96 262.7, 81.94 68.22, 25.32 in-in in 8.4984 Saltbr-in 2.8294 HRD-in -69.96, -52.7 76.88, -14.52 in-out-out SNCioo out-out ActLoopNT-out 16.5343 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_oioo APE10-dihe-na -126.47, 117.16 APE9-dihe-na -77.09, 129.32 APE8-dihe-out -52.48, -42.5 APE8-rot-in 292.76 APE67-dihe-in -62.21, -22.05 -58.1, -28.96 APE12-dist-out 14.7632 APE11-dist-in 12.8512 APE10-dist-out 12.7487 APE9-dist-out 10.3175 None TPO180,PTR182 TPO180,PTR182 XRAY 1.95 0.144 0.189 A 360.0 344.0 5 25 20 5 [[24, 308]] 1.0 9cj3 Homo sapiens CMGC_MAPK14_HUMAN CMGC 5.9e-85 291.1 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_HUMAN 9CJ5A Q16539 5 352 360.0 A1AWV:404,PDO:405 Type2,Allosteric Inactive DFGout 15.6037 9.9462 None -161.07, 167.42 -158.02, 105.92 -133.23, 63.25 67.22, 124.33 -54.97, -26.0 in-in in 8.6967 Saltbr-in 2.7666 HRD-in -81.64, -51.08 76.49, -58.0 in-none-out SNCino none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nooo APE10-dihe-na -113.44, 119.12 APE9-dihe-na -66.71, 142.75 APE8-dihe-out -74.59, -35.87 APE8-rot-in 303.87 APE67-dihe-in -57.3, -25.76 -59.56, -25.3 APE12-dist-none 999.0 APE11-dist-out 14.2449 APE10-dist-out 15.0331 APE9-dist-out 11.8063 None None None XRAY 3.3 0.247 0.276 A 360.0 334.0 11 25 19 6 [[24, 308]] 1.0 9cj5 Homo sapiens CMGC_MAPK14_HUMAN CMGC 5.9e-85 291.1 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14

Ligand: A1AWV

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