Ligand: 6GI

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 7W5OB
DFGin BLBminus 1 50.0% 8YD9A
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 MAPK1 MK01_HUMAN 7W5OB P28482 12 357 360.0 6GI:606 Allosteric Inactive DFGin 6.7291 15.966 BLAminus -130.99, -179.63 60.79, 79.04 -97.44, 21.46 284.57, 69.25 -51.76, -37.4 in-in in 9.205 Saltbr-in 2.9255 HRD-in -89.57, -49.89 81.11, -2.76 in-in-out SNCiio in-out ActLoopNT-in 2.6945 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -127.79, 113.11 APE9-dihe-na 67.74, 140.06 APE8-dihe-in -61.14, 150.09 APE8-rot-in 295.42 APE67-dihe-in -62.08, -24.55 -59.37, -51.13 APE12-dist-in 8.0847 APE11-dist-out 7.278 APE10-dist-in 7.6425 APE9-dist-in 2.9693 None None NEP125 XRAY 2.35 0.228 0.279 B 368.0 346.0 0 31 31 0 [[25, 313]] 1.0 7w5o CMGC_MAPK1_HUMAN CMGC 9.9e-86 293.6 1.0 301.0 301.0 166 167 168 170 172 54 71 75 146 148 147 149.0 210 197 192 191 190 189 188 187 186 106 Mitogen-activated protein kinase 1
CMGC MAPK14 MK14_HUMAN 8YD9A Q16539 4 353 360.0 6GI:401 Allosteric Inactive DFGin 7.5603 16.6454 BLBminus -120.34, 169.61 41.78, 72.62 -60.87, 160.51 290.17, 61.87 -80.92, 82.21 in-in in 9.6172 Saltbr-in 2.8449 HRD-in -66.62, -54.49 86.21, -14.87 in-out-out SNCioo out-out ActLoopNT-out 10.7168 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oooo APE10-dihe-na -136.56, 132.3 APE9-dihe-na -62.85, -15.25 APE8-dihe-out -63.39, -16.12 APE8-rot-out 50.03 APE67-dihe-in -65.78, -19.25 -116.75, -17.41 APE12-dist-out 21.9239 APE11-dist-out 24.1116 APE10-dist-out 18.3983 APE9-dist-out 11.85 None None None XRAY 1.66 0.163 0.205 A 360.0 350.0 0 25 25 0 [[24, 308]] 1.0 8yd9 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: 6GI

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 7W5OB
DFGin BLBminus 1 50.0% 8YD9A
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 MAPK1 MK01_HUMAN 7W5OB P28482 12 357 360.0 6GI:606 Allosteric Inactive DFGin 6.7291 15.966 BLAminus -130.99, -179.63 60.79, 79.04 -97.44, 21.46 284.57, 69.25 -51.76, -37.4 in-in in 9.205 Saltbr-in 2.9255 HRD-in -89.57, -49.89 81.11, -2.76 in-in-out SNCiio in-out ActLoopNT-in 2.6945 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -127.79, 113.11 APE9-dihe-na 67.74, 140.06 APE8-dihe-in -61.14, 150.09 APE8-rot-in 295.42 APE67-dihe-in -62.08, -24.55 -59.37, -51.13 APE12-dist-in 8.0847 APE11-dist-out 7.278 APE10-dist-in 7.6425 APE9-dist-in 2.9693 None None NEP125 XRAY 2.35 0.228 0.279 B 368.0 346.0 0 31 31 0 [[25, 313]] 1.0 7w5o Homo sapiens CMGC_MAPK1_HUMAN CMGC 9.9e-86 293.6 1.0 301.0 301.0 166 167 168 170 172 54 71 75 146 148 147 149.0 210 197 192 191 190 189 188 187 186 106 Mitogen-activated protein kinase 1
CMGC MAPK14 MK14_HUMAN 8YD9A Q16539 4 353 360.0 6GI:401 Allosteric Inactive DFGin 7.5603 16.6454 BLBminus -120.34, 169.61 41.78, 72.62 -60.87, 160.51 290.17, 61.87 -80.92, 82.21 in-in in 9.6172 Saltbr-in 2.8449 HRD-in -66.62, -54.49 86.21, -14.87 in-out-out SNCioo out-out ActLoopNT-out 10.7168 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oooo APE10-dihe-na -136.56, 132.3 APE9-dihe-na -62.85, -15.25 APE8-dihe-out -63.39, -16.12 APE8-rot-out 50.03 APE67-dihe-in -65.78, -19.25 -116.75, -17.41 APE12-dist-out 21.9239 APE11-dist-out 24.1116 APE10-dist-out 18.3983 APE9-dist-out 11.85 None None None XRAY 1.66 0.163 0.205 A 360.0 350.0 0 25 25 0 [[24, 308]] 1.0 8yd9 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: 6GI

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