Ligand: RKN

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% 5MP8A
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 5MP8A P68400 3 327 391.0 ADP:404,RKN:406 ATPlike,Allosteric Active DFGin 7.3305 16.1632 BLAminus -110.84, -174.11 53.51, 76.37 -93.65, 17.26 296.86, 81.68 -66.57, -22.0 in-in in 9.3173 Saltbr-in 2.8626 HRD-in -67.91, -49.16 67.59, 13.12 in-in-in SNCiii in-in ActLoopNT-in 2.9047 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.47, 167.73 APE9-dihe-na 65.86, 165.2 APE8-dihe-in -87.13, 142.99 APE8-rot-in 303.44 APE67-dihe-in -64.04, -21.15 -31.41, -58.51 APE12-dist-in 12.6867 APE11-dist-in 10.4641 APE10-dist-in 6.121 APE9-dist-in 3.1624 R21S None None XRAY 1.92 0.213 0.224 A 352.0 325.0 0 27 27 0 [[39, 324]] 1.0 5mp8 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 5MP8B P68400 3 325 391.0 ADP:402,RKN:405 ATPlike,Allosteric Active DFGin 7.3235 16.3489 BLAminus -110.28, -174.91 53.58, 76.31 -93.48, 18.26 296.68, 81.06 -66.02, -21.8 in-in in 9.4483 Saltbr-in 2.9073 HRD-in -64.03, -48.98 66.77, 13.43 in-in-in SNCiii in-in ActLoopNT-in 2.9117 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.49, 167.73 APE9-dihe-na 66.13, 163.08 APE8-dihe-in -85.62, 144.24 APE8-rot-in 302.43 APE67-dihe-in -63.28, -21.33 -32.96, -58.46 APE12-dist-in 12.6455 APE11-dist-in 10.3733 APE10-dist-in 6.1129 APE9-dist-in 3.1511 R21S None None XRAY 1.92 0.213 0.224 B 352.0 323.0 0 27 27 0 [[39, 324]] 1.0 5mp8 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: RKN

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% 5MP8A
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 5MP8A P68400 3 327 391.0 ADP:404,RKN:406 ATPlike,Allosteric Active DFGin 7.3305 16.1632 BLAminus -110.84, -174.11 53.51, 76.37 -93.65, 17.26 296.86, 81.68 -66.57, -22.0 in-in in 9.3173 Saltbr-in 2.8626 HRD-in -67.91, -49.16 67.59, 13.12 in-in-in SNCiii in-in ActLoopNT-in 2.9047 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.47, 167.73 APE9-dihe-na 65.86, 165.2 APE8-dihe-in -87.13, 142.99 APE8-rot-in 303.44 APE67-dihe-in -64.04, -21.15 -31.41, -58.51 APE12-dist-in 12.6867 APE11-dist-in 10.4641 APE10-dist-in 6.121 APE9-dist-in 3.1624 R21S None None XRAY 1.92 0.213 0.224 A 352.0 325.0 0 27 27 0 [[39, 324]] 1.0 5mp8 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 5MP8B P68400 3 325 391.0 ADP:402,RKN:405 ATPlike,Allosteric Active DFGin 7.3235 16.3489 BLAminus -110.28, -174.91 53.58, 76.31 -93.48, 18.26 296.68, 81.06 -66.02, -21.8 in-in in 9.4483 Saltbr-in 2.9073 HRD-in -64.03, -48.98 66.77, 13.43 in-in-in SNCiii in-in ActLoopNT-in 2.9117 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.49, 167.73 APE9-dihe-na 66.13, 163.08 APE8-dihe-in -85.62, 144.24 APE8-rot-in 302.43 APE67-dihe-in -63.28, -21.33 -32.96, -58.46 APE12-dist-in 12.6455 APE11-dist-in 10.3733 APE10-dist-in 6.1129 APE9-dist-in 3.1511 R21S None None XRAY 1.92 0.213 0.224 B 352.0 323.0 0 27 27 0 [[39, 324]] 1.0 5mp8 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: RKN

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