Ligand: IQ6

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% 4IQ6B
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 4IQ6A P49841 37 382 420.0 IQ6:501 Type1 Active DFGin 7.0678 14.0082 BLAminus -142.1, 176.37 68.23, 72.95 -88.9, 16.75 291.61, 92.77 -55.61, -37.28 in-in in 8.5737 Saltbr-in 2.8412 HRD-in -66.67, -43.42 72.45, -14.35 in-in-in SNCiii in-in ActLoopNT-in 3.0118 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -77.44, 163.79 APE9-dihe-na 84.06, 140.31 APE8-dihe-in -95.86, 141.6 APE8-rot-in 294.32 APE67-dihe-inflip 102.08, -40.06 -38.49, 130.32 APE12-dist-in 13.2141 APE11-dist-in 11.0068 APE10-dist-in 6.1934 APE9-dist-in 3.1668 None None None XRAY 3.12 0.188 0.227 A 426.0 324.0 22 27 27 0 [[56, 340]] 1.0 4iq6 CMGC_GSK3B_HUMAN CMGC 3.4e-70 242.8 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 4IQ6B P49841 37 382 420.0 IQ6:501 Type1.5_Back Active DFGin 7.0646 14.0574 BLAminus -142.54, 175.49 69.06, 72.09 -88.69, 16.42 291.37, 92.47 -54.24, -38.91 in-in in 8.6089 Saltbr-in 2.85 HRD-in -66.96, -42.68 72.42, -15.31 in-in-in SNCiii in-in ActLoopNT-in 3.0094 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -82.08, 167.69 APE9-dihe-na 81.68, 134.42 APE8-dihe-in -80.06, 146.43 APE8-rot-in 285.37 APE67-dihe-inflip 104.71, -27.8 -48.51, 126.71 APE12-dist-in 13.1481 APE11-dist-in 10.9082 APE10-dist-in 6.2442 APE9-dist-in 3.1149 None None None XRAY 3.12 0.188 0.227 B 426.0 332.0 14 27 27 0 [[56, 340]] 1.0 4iq6 CMGC_GSK3B_HUMAN CMGC 3.4e-70 242.8 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: IQ6

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% 4IQ6B
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 4IQ6A P49841 37 382 420.0 IQ6:501 Type1 Active DFGin 7.0678 14.0082 BLAminus -142.1, 176.37 68.23, 72.95 -88.9, 16.75 291.61, 92.77 -55.61, -37.28 in-in in 8.5737 Saltbr-in 2.8412 HRD-in -66.67, -43.42 72.45, -14.35 in-in-in SNCiii in-in ActLoopNT-in 3.0118 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -77.44, 163.79 APE9-dihe-na 84.06, 140.31 APE8-dihe-in -95.86, 141.6 APE8-rot-in 294.32 APE67-dihe-inflip 102.08, -40.06 -38.49, 130.32 APE12-dist-in 13.2141 APE11-dist-in 11.0068 APE10-dist-in 6.1934 APE9-dist-in 3.1668 None None None XRAY 3.12 0.188 0.227 A 426.0 324.0 22 27 27 0 [[56, 340]] 1.0 4iq6 Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.4e-70 242.8 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 4IQ6B P49841 37 382 420.0 IQ6:501 Type1.5_Back Active DFGin 7.0646 14.0574 BLAminus -142.54, 175.49 69.06, 72.09 -88.69, 16.42 291.37, 92.47 -54.24, -38.91 in-in in 8.6089 Saltbr-in 2.85 HRD-in -66.96, -42.68 72.42, -15.31 in-in-in SNCiii in-in ActLoopNT-in 3.0094 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -82.08, 167.69 APE9-dihe-na 81.68, 134.42 APE8-dihe-in -80.06, 146.43 APE8-rot-in 285.37 APE67-dihe-inflip 104.71, -27.8 -48.51, 126.71 APE12-dist-in 13.1481 APE11-dist-in 10.9082 APE10-dist-in 6.2442 APE9-dist-in 3.1149 None None None XRAY 3.12 0.188 0.227 B 426.0 332.0 14 27 27 0 [[56, 340]] 1.0 4iq6 Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.4e-70 242.8 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: IQ6

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