Ligand: TMU

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% 1Q5KA
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 GSK3B GSK3B_HUMAN 1Q5KA P49841 35 384 420.0 TMU:901 Type1 Active DFGin 6.9883 13.8632 BLAminus -136.18, -175.74 56.25, 81.9 -94.66, 24.16 283.53, 73.95 -64.32, -18.01 in-in in 8.2268 Saltbr-in 2.5487 HRD-in -67.21, -47.72 71.71, 7.94 in-in-in SNCiii in-in ActLoopNT-in 2.9814 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -94.63, 174.67 APE9-dihe-na 78.79, 134.14 APE8-dihe-in -77.03, 144.65 APE8-rot-in 302.42 APE67-dihe-inflip 99.66, -34.41 -53.93, 140.09 APE12-dist-in 12.9051 APE11-dist-in 11.0016 APE10-dist-in 5.832 APE9-dist-in 3.1437 None None None XRAY 1.94 0.222 0.242 A 414.0 345.0 5 27 27 0 [[56, 340]] 1.0 1q5k CMGC_GSK3B_HUMAN CMGC 3.1e-70 242.9 1.0 301.0 301.0 199 200 201 203 205 85 97 101 178 180 179 181.0 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 1Q5KB P49841 35 384 420.0 TMU:902 Type1 Active DFGin 6.9852 13.7726 BLAminus -138.67, -177.12 58.86, 79.46 -94.38, 28.16 285.34, 70.82 -69.41, -14.87 in-in in 8.1321 Saltbr-in 2.8315 HRD-in -69.04, -44.01 68.27, 5.21 in-in-in SNCiii in-in ActLoopNT-in 2.9161 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -92.05, 176.86 APE9-dihe-na 75.09, 135.72 APE8-dihe-in -79.59, 144.98 APE8-rot-in 303.4 APE67-dihe-inflip 93.62, -37.01 -50.51, 145.1 APE12-dist-in 12.9305 APE11-dist-in 11.072 APE10-dist-in 5.8459 APE9-dist-in 3.1034 None None None XRAY 1.94 0.222 0.242 B 414.0 344.0 6 27 27 0 [[56, 340]] 1.0 1q5k CMGC_GSK3B_HUMAN CMGC 3.1e-70 242.9 1.0 301.0 301.0 199 200 201 203 205 85 97 101 178 180 179 181.0 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta

Ligand: TMU

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% 1Q5KA
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 GSK3B GSK3B_HUMAN 1Q5KA P49841 35 384 420.0 TMU:901 Type1 Active DFGin 6.9883 13.8632 BLAminus -136.18, -175.74 56.25, 81.9 -94.66, 24.16 283.53, 73.95 -64.32, -18.01 in-in in 8.2268 Saltbr-in 2.5487 HRD-in -67.21, -47.72 71.71, 7.94 in-in-in SNCiii in-in ActLoopNT-in 2.9814 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -94.63, 174.67 APE9-dihe-na 78.79, 134.14 APE8-dihe-in -77.03, 144.65 APE8-rot-in 302.42 APE67-dihe-inflip 99.66, -34.41 -53.93, 140.09 APE12-dist-in 12.9051 APE11-dist-in 11.0016 APE10-dist-in 5.832 APE9-dist-in 3.1437 None None None XRAY 1.94 0.222 0.242 A 414.0 345.0 5 27 27 0 [[56, 340]] 1.0 1q5k Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.1e-70 242.9 1.0 301.0 301.0 199 200 201 203 205 85 97 101 178 180 179 181.0 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 1Q5KB P49841 35 384 420.0 TMU:902 Type1 Active DFGin 6.9852 13.7726 BLAminus -138.67, -177.12 58.86, 79.46 -94.38, 28.16 285.34, 70.82 -69.41, -14.87 in-in in 8.1321 Saltbr-in 2.8315 HRD-in -69.04, -44.01 68.27, 5.21 in-in-in SNCiii in-in ActLoopNT-in 2.9161 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -92.05, 176.86 APE9-dihe-na 75.09, 135.72 APE8-dihe-in -79.59, 144.98 APE8-rot-in 303.4 APE67-dihe-inflip 93.62, -37.01 -50.51, 145.1 APE12-dist-in 12.9305 APE11-dist-in 11.072 APE10-dist-in 5.8459 APE9-dist-in 3.1034 None None None XRAY 1.94 0.222 0.242 B 414.0 344.0 6 27 27 0 [[56, 340]] 1.0 1q5k Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.1e-70 242.9 1.0 301.0 301.0 199 200 201 203 205 85 97 101 178 180 179 181.0 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta

Ligand: TMU

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