Ligand: A1I90

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 9QSRA
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 CSNK2A1 CSK21_HUMAN 9QSRA P68400 3 332 391.0 A1I90:401 Type1 Inactive DFGin 7.4727 16.2756 BLAminus -129.4, -153.69 17.2, 93.17 -99.12, 25.83 303.65, 76.74 -71.34, -17.24 in-in in 9.4066 Saltbr-in 3.2151 HRD-in -68.5, -47.24 76.3, 1.94 in-in-out SNCiio in-out ActLoopNT-in 2.8837 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -134.84, 158.95 APE9-dihe-na 64.32, 165.47 APE8-dihe-in -94.63, 158.49 APE8-rot-out 46.58 APE67-dihe-in -73.19, -15.03 -52.94, -40.64 APE12-dist-in 12.9146 APE11-dist-in 10.887 APE10-dist-in 6.1873 APE9-dist-in 3.7335 None None None XRAY 2.83 0.271 0.326 A 359.0 330.0 0 27 27 0 [[39, 324]] 1.0 9qsr CMGC_CSNK2A1_HUMAN CMGC 1.7e-69 240.3 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 9QSRB P68400 3 332 391.0 A1I90:403 Type1 Active DFGin 7.608 16.3265 BLAminus -123.77, -178.88 43.48, 81.0 -91.13, 29.86 305.89, 77.96 -70.55, -24.4 in-in in 9.5801 Saltbr-in 2.8227 HRD-in -73.55, -45.34 71.01, 12.46 in-in-in SNCiii in-in ActLoopNT-in 2.8564 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -115.95, 174.4 APE9-dihe-na 63.95, 172.55 APE8-dihe-in -98.84, 149.46 APE8-rot-in 273.88 APE67-dihe-in -66.6, -1.96 -43.09, -61.5 APE12-dist-in 12.681 APE11-dist-in 10.6425 APE10-dist-in 6.4743 APE9-dist-in 3.5611 None None None XRAY 2.83 0.271 0.326 B 359.0 330.0 0 27 27 0 [[39, 324]] 1.0 9qsr CMGC_CSNK2A1_HUMAN CMGC 1.7e-69 240.3 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: A1I90

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 9QSRA
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 CSNK2A1 CSK21_HUMAN 9QSRA P68400 3 332 391.0 A1I90:401 Type1 Inactive DFGin 7.4727 16.2756 BLAminus -129.4, -153.69 17.2, 93.17 -99.12, 25.83 303.65, 76.74 -71.34, -17.24 in-in in 9.4066 Saltbr-in 3.2151 HRD-in -68.5, -47.24 76.3, 1.94 in-in-out SNCiio in-out ActLoopNT-in 2.8837 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -134.84, 158.95 APE9-dihe-na 64.32, 165.47 APE8-dihe-in -94.63, 158.49 APE8-rot-out 46.58 APE67-dihe-in -73.19, -15.03 -52.94, -40.64 APE12-dist-in 12.9146 APE11-dist-in 10.887 APE10-dist-in 6.1873 APE9-dist-in 3.7335 None None None XRAY 2.83 0.271 0.326 A 359.0 330.0 0 27 27 0 [[39, 324]] 1.0 9qsr Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.7e-69 240.3 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 9QSRB P68400 3 332 391.0 A1I90:403 Type1 Active DFGin 7.608 16.3265 BLAminus -123.77, -178.88 43.48, 81.0 -91.13, 29.86 305.89, 77.96 -70.55, -24.4 in-in in 9.5801 Saltbr-in 2.8227 HRD-in -73.55, -45.34 71.01, 12.46 in-in-in SNCiii in-in ActLoopNT-in 2.8564 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -115.95, 174.4 APE9-dihe-na 63.95, 172.55 APE8-dihe-in -98.84, 149.46 APE8-rot-in 273.88 APE67-dihe-in -66.6, -1.96 -43.09, -61.5 APE12-dist-in 12.681 APE11-dist-in 10.6425 APE10-dist-in 6.4743 APE9-dist-in 3.5611 None None None XRAY 2.83 0.271 0.326 B 359.0 330.0 0 27 27 0 [[39, 324]] 1.0 9qsr Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.7e-69 240.3 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: A1I90

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