Ligand: 65A

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% 5HLPA
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 5HLPA P49841 36 382 420.0 65A:501 Type1 Active DFGin 7.1863 14.396 BLAminus -136.58, -178.8 62.45, 78.77 -95.76, 20.37 283.01, 75.68 -68.07, -12.1 in-in in 8.1462 Saltbr-in 2.605 HRD-in -72.39, -43.73 64.36, 19.61 in-in-in SNCiii in-in ActLoopNT-in 2.8712 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -139.83, 176.24 APE9-dihe-na 71.02, 146.23 APE8-dihe-in -63.35, 144.14 APE8-rot-in 289.42 APE67-dihe-in -64.86, -21.95 -54.37, -48.38 APE12-dist-in 13.6671 APE11-dist-in 11.8195 APE10-dist-in 6.6439 APE9-dist-in 3.2984 None PTR216,TPO277 PTR216,TPO277 XRAY 2.45 0.19 0.24 A 424.0 339.0 8 27 27 0 [[56, 340]] 1.0 5hlp CMGC_GSK3B_HUMAN CMGC 3.3e-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 5HLPB P49841 36 383 420.0 65A:501 Type1 Active DFGin 7.1151 14.4669 BLAminus -132.96, -174.02 57.79, 78.12 -94.26, 22.08 284.54, 74.66 -71.61, -17.17 in-in in 8.276 Saltbr-in 2.7164 HRD-in -71.48, -47.76 70.66, 10.73 in-in-in SNCiii in-in ActLoopNT-in 2.8371 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -144.37, 176.63 APE9-dihe-na 72.15, 149.52 APE8-dihe-in -67.13, 142.42 APE8-rot-in 293.57 APE67-dihe-in -63.1, -24.66 -49.41, -51.54 APE12-dist-in 13.356 APE11-dist-in 11.8213 APE10-dist-in 6.5807 APE9-dist-in 3.1348 None PTR216,TPO277 PTR216,TPO277 XRAY 2.45 0.19 0.24 B 424.0 337.0 11 27 27 0 [[56, 340]] 1.0 5hlp CMGC_GSK3B_HUMAN CMGC 3.3e-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: 65A

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% 5HLPA
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 5HLPA P49841 36 382 420.0 65A:501 Type1 Active DFGin 7.1863 14.396 BLAminus -136.58, -178.8 62.45, 78.77 -95.76, 20.37 283.01, 75.68 -68.07, -12.1 in-in in 8.1462 Saltbr-in 2.605 HRD-in -72.39, -43.73 64.36, 19.61 in-in-in SNCiii in-in ActLoopNT-in 2.8712 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -139.83, 176.24 APE9-dihe-na 71.02, 146.23 APE8-dihe-in -63.35, 144.14 APE8-rot-in 289.42 APE67-dihe-in -64.86, -21.95 -54.37, -48.38 APE12-dist-in 13.6671 APE11-dist-in 11.8195 APE10-dist-in 6.6439 APE9-dist-in 3.2984 None PTR216,TPO277 PTR216,TPO277 XRAY 2.45 0.19 0.24 A 424.0 339.0 8 27 27 0 [[56, 340]] 1.0 5hlp Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.3e-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 5HLPB P49841 36 383 420.0 65A:501 Type1 Active DFGin 7.1151 14.4669 BLAminus -132.96, -174.02 57.79, 78.12 -94.26, 22.08 284.54, 74.66 -71.61, -17.17 in-in in 8.276 Saltbr-in 2.7164 HRD-in -71.48, -47.76 70.66, 10.73 in-in-in SNCiii in-in ActLoopNT-in 2.8371 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -144.37, 176.63 APE9-dihe-na 72.15, 149.52 APE8-dihe-in -67.13, 142.42 APE8-rot-in 293.57 APE67-dihe-in -63.1, -24.66 -49.41, -51.54 APE12-dist-in 13.356 APE11-dist-in 11.8213 APE10-dist-in 6.5807 APE9-dist-in 3.1348 None PTR216,TPO277 PTR216,TPO277 XRAY 2.45 0.19 0.24 B 424.0 337.0 11 27 27 0 [[56, 340]] 1.0 5hlp Homo sapiens CMGC_GSK3B_HUMAN CMGC 3.3e-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: 65A

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