Ligand: 39I

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 7OY6C
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 DYRK1A DYR1A_HUMAN 7OY6C Q13627 135 481 763.0 39I:501 Type1 Inactive DFGin 7.648 15.4 BLAminus -125.83, 168.21 66.48, 82.31 -94.71, 17.96 280.2, 86.53 -72.92, -24.78 in-in in 8.812 Saltbr-in 3.231 HRD-in -68.26, -38.56 68.22, 7.69 in-in-out SNCiio in-out ActLoopNT-in 2.664 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oioi APE10-dihe-na -109.61, 169.12 APE9-dihe-na 78.1, 158.02 APE8-dihe-in -72.9, 138.3 APE8-rot-out 215.64 APE67-dihe-in -58.63, -31.51 -47.01, -53.58 APE12-dist-out 14.468 APE11-dist-in 12.493 APE10-dist-out 8.058 APE9-dist-in 3.359 None PTR321 PTR321 XRAY 2.38 0.202 0.27 C 359 343 4 0 0 0 [[159, 479]] 1.0 7oy6 CMGC_DYRK1A_HUMAN CMGC 8.2e-91 310.2 1 301 301 306 307 308 310 312 188 203 207 284 286 285 287 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC GSK3B GSK3B_HUMAN 7OY5A P49841 35 385 420.0 39I:401 Type1 Active DFGin 6.926 14.033 BLAminus -126.76, 175.34 72.52, 92.63 -110.59, 33.29 286.05, 82.06 -75.35, -28.56 in-in in 8.688 Saltbr-in 2.936 HRD-in -72.48, -55.14 81.29, 7.92 in-in-in SNCiii in-in ActLoopNT-in 2.917 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -78.43, 173.86 APE9-dihe-na 80.53, 146.3 APE8-dihe-in -94.81, 142.24 APE8-rot-in 295.61 APE67-dihe-inflip 101.01, -30.19 -44.76, 139.01 APE12-dist-in 12.924 APE11-dist-in 10.96 APE10-dist-in 5.893 APE9-dist-in 3.276 None None None XRAY 2.57 0.221 0.26 A 351 343 8 0 0 0 [[56, 340]] 1.0 7oy5 CMGC_GSK3B_HUMAN CMGC 1.8e-70 243.7 1 301 301 199 200 201 203 205 85 97 101 178 180 179 181 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 7OY5B P49841 35 383 420.0 39I:401 Type1 Active DFGin 7.115 14.145 BLAminus -131.55, -176.92 63.09, 57.6 -70.26, 11.8 285.25, 87.17 -66.04, -15.46 in-in in 8.495 Saltbr-in 3.027 HRD-in -75.85, -49.73 71.52, 4.36 in-in-in SNCiii in-in ActLoopNT-in 3.039 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -92.28, 172.83 APE9-dihe-na 79.24, 135.47 APE8-dihe-in -76.12, 154.7 APE8-rot-in 287.59 APE67-dihe-inflip 110.96, -34.61 -67.01, 135.0 APE12-dist-in 13.03 APE11-dist-in 10.958 APE10-dist-in 5.992 APE9-dist-in 3.008 None None None XRAY 2.57 0.221 0.26 B 351 344 5 0 0 0 [[56, 340]] 1.0 7oy5 CMGC_GSK3B_HUMAN CMGC 1.8e-70 243.7 1 301 301 199 200 201 203 205 85 97 101 178 180 179 181 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta

Ligand: 39I

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 7OY6C
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 DYRK1A DYR1A_HUMAN 7OY6C Q13627 135 481 763.0 39I:501 Type1 Inactive DFGin 7.648 15.4 BLAminus -125.83, 168.21 66.48, 82.31 -94.71, 17.96 280.2, 86.53 -72.92, -24.78 in-in in 8.812 Saltbr-in 3.231 HRD-in -68.26, -38.56 68.22, 7.69 in-in-out SNCiio in-out ActLoopNT-in 2.664 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oioi APE10-dihe-na -109.61, 169.12 APE9-dihe-na 78.1, 158.02 APE8-dihe-in -72.9, 138.3 APE8-rot-out 215.64 APE67-dihe-in -58.63, -31.51 -47.01, -53.58 APE12-dist-out 14.468 APE11-dist-in 12.493 APE10-dist-out 8.058 APE9-dist-in 3.359 None PTR321 PTR321 XRAY 2.38 0.202 0.27 C 359 343 4 0 0 0 [[159, 479]] 1.0 7oy6 Homo sapiens CMGC_DYRK1A_HUMAN CMGC 8.2e-91 310.2 1 301 301 306 307 308 310 312 188 203 207 284 286 285 287 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC GSK3B GSK3B_HUMAN 7OY5A P49841 35 385 420.0 39I:401 Type1 Active DFGin 6.926 14.033 BLAminus -126.76, 175.34 72.52, 92.63 -110.59, 33.29 286.05, 82.06 -75.35, -28.56 in-in in 8.688 Saltbr-in 2.936 HRD-in -72.48, -55.14 81.29, 7.92 in-in-in SNCiii in-in ActLoopNT-in 2.917 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -78.43, 173.86 APE9-dihe-na 80.53, 146.3 APE8-dihe-in -94.81, 142.24 APE8-rot-in 295.61 APE67-dihe-inflip 101.01, -30.19 -44.76, 139.01 APE12-dist-in 12.924 APE11-dist-in 10.96 APE10-dist-in 5.893 APE9-dist-in 3.276 None None None XRAY 2.57 0.221 0.26 A 351 343 8 0 0 0 [[56, 340]] 1.0 7oy5 Homo sapiens CMGC_GSK3B_HUMAN CMGC 1.8e-70 243.7 1 301 301 199 200 201 203 205 85 97 101 178 180 179 181 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 7OY5B P49841 35 383 420.0 39I:401 Type1 Active DFGin 7.115 14.145 BLAminus -131.55, -176.92 63.09, 57.6 -70.26, 11.8 285.25, 87.17 -66.04, -15.46 in-in in 8.495 Saltbr-in 3.027 HRD-in -75.85, -49.73 71.52, 4.36 in-in-in SNCiii in-in ActLoopNT-in 3.039 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -92.28, 172.83 APE9-dihe-na 79.24, 135.47 APE8-dihe-in -76.12, 154.7 APE8-rot-in 287.59 APE67-dihe-inflip 110.96, -34.61 -67.01, 135.0 APE12-dist-in 13.03 APE11-dist-in 10.958 APE10-dist-in 5.992 APE9-dist-in 3.008 None None None XRAY 2.57 0.221 0.26 B 351 344 5 0 0 0 [[56, 340]] 1.0 7oy5 Homo sapiens CMGC_GSK3B_HUMAN CMGC 1.8e-70 243.7 1 301 301 199 200 201 203 205 85 97 101 178 180 179 181 239 226 221 220 219 218 217 216 215 133 Glycogen synthase kinase-3 beta

Ligand: 39I

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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