Ligand: A4Q

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% 5ORJB
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 5ORJB P68400 4 327 391.0 ADP:403,A4Q:404 ATPlike,Allosteric Active DFGin 7.2646 16.3413 BLAminus -111.15, -176.6 55.76, 79.82 -97.57, 16.74 293.2, 81.02 -66.75, -20.87 in-in in 9.4788 Saltbr-in 3.0155 HRD-in -67.24, -46.68 66.46, 8.84 in-in-in SNCiii in-in ActLoopNT-in 2.9685 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -129.61, 174.53 APE9-dihe-na 65.24, 168.77 APE8-dihe-in -97.72, 138.95 APE8-rot-in 305.57 APE67-dihe-in -64.92, -22.35 -27.33, -57.79 APE12-dist-in 12.6095 APE11-dist-in 10.4061 APE10-dist-in 6.0013 APE9-dist-in 3.1263 R21S None None XRAY 1.99 0.201 0.221 B 352.0 324.0 0 27 27 0 [[39, 324]] 1.0 5orj CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 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 5ORJA P68400 3 327 391.0 ADP:404,A4Q:405,A4Q:406,IHP:407 ATPlike,Allosteric,Allosteric,Allosteric Active DFGin 7.3152 16.1818 BLAminus -113.3, -173.8 55.0, 78.92 -98.71, 18.23 293.93, 79.8 -66.17, -22.25 in-in in 9.3296 Saltbr-in 3.0231 HRD-in -76.84, -43.62 65.1, 10.62 in-in-in SNCiii in-in ActLoopNT-in 2.9091 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.05, 173.87 APE9-dihe-na 60.43, 175.34 APE8-dihe-in -100.91, 141.29 APE8-rot-in 294.98 APE67-dihe-in -64.65, -20.18 -32.63, -57.01 APE12-dist-in 12.6896 APE11-dist-in 10.5231 APE10-dist-in 6.1349 APE9-dist-in 3.1729 R21S None None XRAY 1.99 0.201 0.221 A 352.0 325.0 0 27 27 0 [[39, 324]] 1.0 5orj CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 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: A4Q

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% 5ORJB
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 5ORJB P68400 4 327 391.0 ADP:403,A4Q:404 ATPlike,Allosteric Active DFGin 7.2646 16.3413 BLAminus -111.15, -176.6 55.76, 79.82 -97.57, 16.74 293.2, 81.02 -66.75, -20.87 in-in in 9.4788 Saltbr-in 3.0155 HRD-in -67.24, -46.68 66.46, 8.84 in-in-in SNCiii in-in ActLoopNT-in 2.9685 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -129.61, 174.53 APE9-dihe-na 65.24, 168.77 APE8-dihe-in -97.72, 138.95 APE8-rot-in 305.57 APE67-dihe-in -64.92, -22.35 -27.33, -57.79 APE12-dist-in 12.6095 APE11-dist-in 10.4061 APE10-dist-in 6.0013 APE9-dist-in 3.1263 R21S None None XRAY 1.99 0.201 0.221 B 352.0 324.0 0 27 27 0 [[39, 324]] 1.0 5orj Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 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 5ORJA P68400 3 327 391.0 ADP:404,A4Q:405,A4Q:406,IHP:407 ATPlike,Allosteric,Allosteric,Allosteric Active DFGin 7.3152 16.1818 BLAminus -113.3, -173.8 55.0, 78.92 -98.71, 18.23 293.93, 79.8 -66.17, -22.25 in-in in 9.3296 Saltbr-in 3.0231 HRD-in -76.84, -43.62 65.1, 10.62 in-in-in SNCiii in-in ActLoopNT-in 2.9091 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.05, 173.87 APE9-dihe-na 60.43, 175.34 APE8-dihe-in -100.91, 141.29 APE8-rot-in 294.98 APE67-dihe-in -64.65, -20.18 -32.63, -57.01 APE12-dist-in 12.6896 APE11-dist-in 10.5231 APE10-dist-in 6.1349 APE9-dist-in 3.1729 R21S None None XRAY 1.99 0.201 0.221 A 352.0 325.0 0 27 27 0 [[39, 324]] 1.0 5orj Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 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: A4Q

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