Ligand: O9L

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8AV1A
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 8AV1A P49841 27 381 420.0 O9L:406 Type1 Inactive DFGin 7.0048 13.8018 BLAminus -134.83, 176.12 61.29, 85.31 -97.92, 27.58 284.57, 74.39 -70.18, -20.31 in-in in 8.4199 Saltbr-in 2.6588 HRD-in -72.82, -53.06 75.09, 11.93 in-in-out SNCiio in-out ActLoopNT-in 2.8108 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -162.3, 153.55 APE9-dihe-na 79.71, 140.85 APE8-dihe-in -55.94, 133.71 APE8-rot-out 187.25 APE67-dihe-in -61.14, -25.49 -46.06, -52.45 APE12-dist-in 13.2676 APE11-dist-in 11.4128 APE10-dist-in 6.8843 APE9-dist-in 3.0607 None PTR216 PTR216 XRAY 2.15 0.18 0.21 A 365.0 351.0 4 27 27 0 [[56, 340]] 1.0 8av1 CMGC_GSK3B_HUMAN CMGC 2.1e-70 243.5 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 8AV1B P49841 27 381 420.0 O9L:405 Type1 Inactive DFGin 7.0411 13.8178 BLAminus -134.53, 176.17 61.15, 83.84 -96.42, 28.03 285.62, 75.68 -72.4, -19.61 in-in in 8.3507 Saltbr-in 2.6481 HRD-in -70.84, -52.05 73.58, 16.86 in-in-out SNCiio in-out ActLoopNT-in 2.809 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -159.36, 152.7 APE9-dihe-na 82.35, 142.4 APE8-dihe-in -57.42, 133.83 APE8-rot-out 184.71 APE67-dihe-in -59.68, -24.96 -48.86, -51.78 APE12-dist-in 13.2597 APE11-dist-in 11.441 APE10-dist-in 6.8498 APE9-dist-in 3.0597 None PTR216 PTR216 XRAY 2.15 0.18 0.21 B 365.0 351.0 4 27 27 0 [[56, 340]] 1.0 8av1 CMGC_GSK3B_HUMAN CMGC 2.1e-70 243.5 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: O9L

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8AV1A
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 8AV1A P49841 27 381 420.0 O9L:406 Type1 Inactive DFGin 7.0048 13.8018 BLAminus -134.83, 176.12 61.29, 85.31 -97.92, 27.58 284.57, 74.39 -70.18, -20.31 in-in in 8.4199 Saltbr-in 2.6588 HRD-in -72.82, -53.06 75.09, 11.93 in-in-out SNCiio in-out ActLoopNT-in 2.8108 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -162.3, 153.55 APE9-dihe-na 79.71, 140.85 APE8-dihe-in -55.94, 133.71 APE8-rot-out 187.25 APE67-dihe-in -61.14, -25.49 -46.06, -52.45 APE12-dist-in 13.2676 APE11-dist-in 11.4128 APE10-dist-in 6.8843 APE9-dist-in 3.0607 None PTR216 PTR216 XRAY 2.15 0.18 0.21 A 365.0 351.0 4 27 27 0 [[56, 340]] 1.0 8av1 Homo sapiens CMGC_GSK3B_HUMAN CMGC 2.1e-70 243.5 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 8AV1B P49841 27 381 420.0 O9L:405 Type1 Inactive DFGin 7.0411 13.8178 BLAminus -134.53, 176.17 61.15, 83.84 -96.42, 28.03 285.62, 75.68 -72.4, -19.61 in-in in 8.3507 Saltbr-in 2.6481 HRD-in -70.84, -52.05 73.58, 16.86 in-in-out SNCiio in-out ActLoopNT-in 2.809 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -159.36, 152.7 APE9-dihe-na 82.35, 142.4 APE8-dihe-in -57.42, 133.83 APE8-rot-out 184.71 APE67-dihe-in -59.68, -24.96 -48.86, -51.78 APE12-dist-in 13.2597 APE11-dist-in 11.441 APE10-dist-in 6.8498 APE9-dist-in 3.0597 None PTR216 PTR216 XRAY 2.15 0.18 0.21 B 365.0 351.0 4 27 27 0 [[56, 340]] 1.0 8av1 Homo sapiens CMGC_GSK3B_HUMAN CMGC 2.1e-70 243.5 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: O9L

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