Ligand: IHP

Total number of chains: 8
Active chains: 8
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 8 100.0% 5CVHA

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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 5CVHA P68400 2 328 391.0 ADP:401,IHP:402 ATPlike,Allosteric Active DFGin 7.351 16.265 BLAminus -108.96, -174.88 56.89, 75.34 -94.42, 15.0 293.73, 80.57 -64.71, -19.68 in-in in 9.418 Saltbr-in 2.869 HRD-in -72.87, -47.99 69.09, 10.68 in-in-in SNCiii in-in ActLoopNT-in 2.901 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.61, 174.2 APE9-dihe-na 62.86, 175.04 APE8-dihe-in -103.43, 141.93 APE8-rot-in 298.78 APE67-dihe-in -64.49, -19.58 -33.62, -57.11 APE12-dist-in 12.739 APE11-dist-in 10.544 APE10-dist-in 6.1 APE9-dist-in 3.115 R21S None None XRAY 1.848 0.204 0.22 A 352 327 0 0 0 0 [[39, 324]] 1.0 5cvh CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5CVHB P68400 4 327 391.0 ADP:401,IHP:402 ATPlike,Allosteric Active DFGin 7.334 16.506 BLAminus -108.95, -175.21 55.5, 76.34 -94.47, 15.14 293.04, 80.42 -64.89, -20.52 in-in in 9.652 Saltbr-in 2.92 HRD-in -71.77, -46.42 66.39, 11.3 in-in-in SNCiii in-in ActLoopNT-in 2.891 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.23, 173.23 APE9-dihe-na 63.78, 174.17 APE8-dihe-in -100.91, 142.72 APE8-rot-in 301.86 APE67-dihe-in -62.55, -20.09 -31.2, -58.6 APE12-dist-in 12.631 APE11-dist-in 10.426 APE10-dist-in 6.037 APE9-dist-in 3.119 R21S None None XRAY 1.848 0.204 0.22 B 352 324 0 0 0 0 [[39, 324]] 1.0 5cvh CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MPJA P68400 3 328 391.0 ADP:401,IHP:402,J2P:403 ATPlike,Allosteric,Allosteric Active DFGin 7.347 16.241 BLAminus -108.98, -172.35 51.93, 78.25 -97.48, 15.87 295.39, 81.91 -64.67, -20.13 in-in in 9.407 Saltbr-in 3.123 HRD-in -65.25, -50.84 66.66, 13.27 in-in-in SNCiii in-in ActLoopNT-in 2.941 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.52, 170.99 APE9-dihe-na 63.12, 171.83 APE8-dihe-in -95.06, 139.24 APE8-rot-in 294.97 APE67-dihe-in -59.9, -28.22 -27.45, -59.89 APE12-dist-in 12.787 APE11-dist-in 10.54 APE10-dist-in 6.103 APE9-dist-in 3.163 R21S None None XRAY 2.14 0.214 0.241 A 352 326 0 0 0 0 [[39, 324]] 1.0 5mpj CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5OQUA P68400 4 327 391.0 ADP:401,A4B:402,IHP:408 ATPlike,Allosteric,Allosteric Active DFGin 7.448 16.25 BLAminus -109.0, -171.89 53.56, 75.1 -98.21, 18.1 294.2, 83.27 -72.09, -15.18 in-in in 9.369 Saltbr-in 2.827 HRD-in -72.33, -46.9 69.21, 10.87 in-in-in SNCiii in-in ActLoopNT-in 2.966 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.38, 169.57 APE9-dihe-na 63.73, 165.9 APE8-dihe-in -87.91, 142.9 APE8-rot-in 295.65 APE67-dihe-in -63.9, -27.03 -35.31, -52.27 APE12-dist-in 12.67 APE11-dist-in 10.466 APE10-dist-in 6.154 APE9-dist-in 3.14 R21S None None XRAY 2.324 0.221 0.244 A 352 324 0 0 0 0 [[39, 324]] 1.0 5oqu CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MOEB P68400 4 326 391.0 ADP:401,IHP:404,OQC:408,OQC:409 ATPlike,Allosteric,Allosteric,Allosteric Active DFGin 7.365 16.336 BLAminus -112.77, -173.88 54.48, 74.44 -91.99, 16.05 295.46, 80.22 -64.57, -20.81 in-in in 9.479 Saltbr-in 2.889 HRD-in -71.14, -46.59 66.38, 12.51 in-in-in SNCiii in-in ActLoopNT-in 2.873 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.91, 173.34 APE9-dihe-na 63.06, 172.04 APE8-dihe-in -102.52, 138.64 APE8-rot-in 304.11 APE67-dihe-in -65.23, -21.43 -26.29, -58.65 APE12-dist-in 12.604 APE11-dist-in 10.405 APE10-dist-in 6.063 APE9-dist-in 3.115 R21S None None XRAY 1.89 0.197 0.208 B 352 323 0 0 0 0 [[39, 324]] 1.0 5moe CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 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 7.315 16.182 BLAminus -113.3, -173.8 55.0, 78.92 -98.71, 18.23 293.93, 79.8 -66.17, -22.25 in-in in 9.33 Saltbr-in 3.023 HRD-in -76.84, -43.62 65.1, 10.62 in-in-in SNCiii in-in ActLoopNT-in 2.909 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 12.69 APE11-dist-in 10.523 APE10-dist-in 6.135 APE9-dist-in 3.173 R21S None None XRAY 1.99 0.201 0.221 A 352 325 0 0 0 0 [[39, 324]] 1.0 5orj CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MOEA P68400 3 327 391.0 ADP:401,IHP:404,OQC:409,OQC:410,OQC:411 ATPlike,Allosteric,Allosteric,Allosteric,Allosteric Active DFGin 7.374 16.184 BLAminus -113.03, -172.32 55.01, 74.02 -92.87, 17.49 295.96, 80.42 -65.27, -21.9 in-in in 9.335 Saltbr-in 2.823 HRD-in -73.11, -47.25 66.93, 11.97 in-in-in SNCiii in-in ActLoopNT-in 2.889 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.86, 173.34 APE9-dihe-na 63.53, 173.35 APE8-dihe-in -101.83, 138.62 APE8-rot-in 302.36 APE67-dihe-in -64.87, -18.25 -29.63, -58.0 APE12-dist-in 12.678 APE11-dist-in 10.501 APE10-dist-in 6.104 APE9-dist-in 3.111 R21S None None XRAY 1.89 0.197 0.208 A 352 325 0 0 0 0 [[39, 324]] 1.0 5moe CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 3W8LB P68400 4 329 391.0 IHP:500,IHP:501 Allosteric,Allosteric Active DFGin 7.728 16.389 BLAminus -117.95, 178.64 63.91, 74.09 -97.55, 23.34 297.06, 82.11 -68.83, -26.32 in-in in 9.415 Saltbr-in 2.844 HRD-in -78.28, -43.36 63.62, 9.02 in-in-in SNCiii in-in ActLoopNT-in 2.76 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.27, 176.58 APE9-dihe-na 62.09, 176.71 APE8-dihe-in -102.52, 146.88 APE8-rot-in 304.12 APE67-dihe-in -72.23, -19.95 -36.06, -50.38 APE12-dist-in 12.787 APE11-dist-in 10.674 APE10-dist-in 5.969 APE9-dist-in 3.075 I57V None None XRAY 2.4 0.235 0.248 B 335 326 0 0 0 0 [[39, 324]] 1.0 3w8l CMGC_CSNK2A1_HUMAN CMGC 1.3e-69 240.6 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: IHP

Total number of chains: 11
Active chains: 9
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 11 100.0% 9TFXAAAA

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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 CKA1 CSK21_ARATH 9TFYA Q08467 78 409 409.0 IHP:60501 Allosteric Inactive DFGin 7.604 15.915 BLAminus -108.4, 178.04 51.79, 81.61 -94.23, 27.46 296.08, 79.09 -65.65, -28.63 in-in in 9.217 Saltbr-in 2.916 HRD-in -69.94, -45.64 63.74, 12.01 in-in-out SNCiio in-out ActLoopNT-in 2.876 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -124.57, 168.72 APE9-dihe-na 64.77, 160.42 APE8-dihe-in -83.27, 140.98 APE8-rot-out 192.4 APE67-dihe-in -64.49, -16.93 -31.68, -55.99 APE12-dist-in 12.643 APE11-dist-in 10.17 APE10-dist-in 6.236 APE9-dist-in 3.218 None None None XRAY 5.5 0.249 0.267 A 344 332 0 0 0 0 [[110, 395]] 1.0 9tfy Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1
CMGC CKA1 CSK21_ARATH 9TFYB Q08467 78 409 409.0 IHP:60501 Allosteric Inactive DFGin 7.601 15.969 BLAminus -108.43, 178.22 51.24, 81.53 -93.75, 27.33 296.05, 79.14 -65.5, -28.9 in-in in 9.25 Saltbr-in 2.92 HRD-in -69.94, -45.44 63.61, 11.28 in-in-out SNCiio in-out ActLoopNT-in 2.874 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -124.63, 168.96 APE9-dihe-na 64.63, 159.97 APE8-dihe-in -82.76, 141.38 APE8-rot-out 191.85 APE67-dihe-in -64.65, -16.88 -31.71, -55.99 APE12-dist-in 12.71 APE11-dist-in 10.235 APE10-dist-in 6.262 APE9-dist-in 3.204 None None None XRAY 5.5 0.249 0.267 B 344 332 0 0 0 0 [[110, 395]] 1.0 9tfy Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1
CMGC CKA1 CSK21_ARATH 9TFXAAAA Q08467 78 409 409.0 IHP:60501,BEZ:60502 Allosteric,Type1 Active DFGin 7.412 16.216 BLAminus -116.9, -179.78 54.45, 79.6 -92.35, 21.74 295.78, 82.7 -67.49, -22.65 in-in in 9.313 Saltbr-in 2.667 HRD-in -75.85, -47.48 69.59, 11.15 in-in-in SNCiii in-in ActLoopNT-in 2.9 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.14, 168.32 APE9-dihe-na 65.61, 162.34 APE8-dihe-in -89.85, 146.8 APE8-rot-in 303.88 APE67-dihe-in -66.65, -11.26 -41.17, -55.31 APE12-dist-in 12.451 APE11-dist-in 9.879 APE10-dist-in 6.027 APE9-dist-in 3.115 None None None XRAY 1.7 0.21 0.24 AAAA 344 332 0 0 0 0 [[110, 395]] 1.0 9tfx Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1
CMGC CSNK2A1 CSK21_HUMAN 5CVHA P68400 2 328 391.0 ADP:401,IHP:402 ATPlike,Allosteric Active DFGin 7.351 16.265 BLAminus -108.96, -174.88 56.89, 75.34 -94.42, 15.0 293.73, 80.57 -64.71, -19.68 in-in in 9.418 Saltbr-in 2.869 HRD-in -72.87, -47.99 69.09, 10.68 in-in-in SNCiii in-in ActLoopNT-in 2.901 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.61, 174.2 APE9-dihe-na 62.86, 175.04 APE8-dihe-in -103.43, 141.93 APE8-rot-in 298.78 APE67-dihe-in -64.49, -19.58 -33.62, -57.11 APE12-dist-in 12.739 APE11-dist-in 10.544 APE10-dist-in 6.1 APE9-dist-in 3.115 R21S None None XRAY 1.848 0.204 0.22 A 352 327 0 0 0 0 [[39, 324]] 1.0 5cvh Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5CVHB P68400 4 327 391.0 ADP:401,IHP:402 ATPlike,Allosteric Active DFGin 7.334 16.506 BLAminus -108.95, -175.21 55.5, 76.34 -94.47, 15.14 293.04, 80.42 -64.89, -20.52 in-in in 9.652 Saltbr-in 2.92 HRD-in -71.77, -46.42 66.39, 11.3 in-in-in SNCiii in-in ActLoopNT-in 2.891 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.23, 173.23 APE9-dihe-na 63.78, 174.17 APE8-dihe-in -100.91, 142.72 APE8-rot-in 301.86 APE67-dihe-in -62.55, -20.09 -31.2, -58.6 APE12-dist-in 12.631 APE11-dist-in 10.426 APE10-dist-in 6.037 APE9-dist-in 3.119 R21S None None XRAY 1.848 0.204 0.22 B 352 324 0 0 0 0 [[39, 324]] 1.0 5cvh Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MPJA P68400 3 328 391.0 ADP:401,IHP:402,J2P:403 ATPlike,Allosteric,Allosteric Active DFGin 7.347 16.241 BLAminus -108.98, -172.35 51.93, 78.25 -97.48, 15.87 295.39, 81.91 -64.67, -20.13 in-in in 9.407 Saltbr-in 3.123 HRD-in -65.25, -50.84 66.66, 13.27 in-in-in SNCiii in-in ActLoopNT-in 2.941 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.52, 170.99 APE9-dihe-na 63.12, 171.83 APE8-dihe-in -95.06, 139.24 APE8-rot-in 294.97 APE67-dihe-in -59.9, -28.22 -27.45, -59.89 APE12-dist-in 12.787 APE11-dist-in 10.54 APE10-dist-in 6.103 APE9-dist-in 3.163 R21S None None XRAY 2.14 0.214 0.241 A 352 326 0 0 0 0 [[39, 324]] 1.0 5mpj Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5OQUA P68400 4 327 391.0 ADP:401,A4B:402,IHP:408 ATPlike,Allosteric,Allosteric Active DFGin 7.448 16.25 BLAminus -109.0, -171.89 53.56, 75.1 -98.21, 18.1 294.2, 83.27 -72.09, -15.18 in-in in 9.369 Saltbr-in 2.827 HRD-in -72.33, -46.9 69.21, 10.87 in-in-in SNCiii in-in ActLoopNT-in 2.966 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.38, 169.57 APE9-dihe-na 63.73, 165.9 APE8-dihe-in -87.91, 142.9 APE8-rot-in 295.65 APE67-dihe-in -63.9, -27.03 -35.31, -52.27 APE12-dist-in 12.67 APE11-dist-in 10.466 APE10-dist-in 6.154 APE9-dist-in 3.14 R21S None None XRAY 2.324 0.221 0.244 A 352 324 0 0 0 0 [[39, 324]] 1.0 5oqu Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MOEB P68400 4 326 391.0 ADP:401,IHP:404,OQC:408,OQC:409 ATPlike,Allosteric,Allosteric,Allosteric Active DFGin 7.365 16.336 BLAminus -112.77, -173.88 54.48, 74.44 -91.99, 16.05 295.46, 80.22 -64.57, -20.81 in-in in 9.479 Saltbr-in 2.889 HRD-in -71.14, -46.59 66.38, 12.51 in-in-in SNCiii in-in ActLoopNT-in 2.873 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.91, 173.34 APE9-dihe-na 63.06, 172.04 APE8-dihe-in -102.52, 138.64 APE8-rot-in 304.11 APE67-dihe-in -65.23, -21.43 -26.29, -58.65 APE12-dist-in 12.604 APE11-dist-in 10.405 APE10-dist-in 6.063 APE9-dist-in 3.115 R21S None None XRAY 1.89 0.197 0.208 B 352 323 0 0 0 0 [[39, 324]] 1.0 5moe Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 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 7.315 16.182 BLAminus -113.3, -173.8 55.0, 78.92 -98.71, 18.23 293.93, 79.8 -66.17, -22.25 in-in in 9.33 Saltbr-in 3.023 HRD-in -76.84, -43.62 65.1, 10.62 in-in-in SNCiii in-in ActLoopNT-in 2.909 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 12.69 APE11-dist-in 10.523 APE10-dist-in 6.135 APE9-dist-in 3.173 R21S None None XRAY 1.99 0.201 0.221 A 352 325 0 0 0 0 [[39, 324]] 1.0 5orj Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 5MOEA P68400 3 327 391.0 ADP:401,IHP:404,OQC:409,OQC:410,OQC:411 ATPlike,Allosteric,Allosteric,Allosteric,Allosteric Active DFGin 7.374 16.184 BLAminus -113.03, -172.32 55.01, 74.02 -92.87, 17.49 295.96, 80.42 -65.27, -21.9 in-in in 9.335 Saltbr-in 2.823 HRD-in -73.11, -47.25 66.93, 11.97 in-in-in SNCiii in-in ActLoopNT-in 2.889 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.86, 173.34 APE9-dihe-na 63.53, 173.35 APE8-dihe-in -101.83, 138.62 APE8-rot-in 302.36 APE67-dihe-in -64.87, -18.25 -29.63, -58.0 APE12-dist-in 12.678 APE11-dist-in 10.501 APE10-dist-in 6.104 APE9-dist-in 3.111 R21S None None XRAY 1.89 0.197 0.208 A 352 325 0 0 0 0 [[39, 324]] 1.0 5moe Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.6e-69 240.4 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha
CMGC CSNK2A1 CSK21_HUMAN 3W8LB P68400 4 329 391.0 IHP:500,IHP:501 Allosteric,Allosteric Active DFGin 7.728 16.389 BLAminus -117.95, 178.64 63.91, 74.09 -97.55, 23.34 297.06, 82.11 -68.83, -26.32 in-in in 9.415 Saltbr-in 2.844 HRD-in -78.28, -43.36 63.62, 9.02 in-in-in SNCiii in-in ActLoopNT-in 2.76 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.27, 176.58 APE9-dihe-na 62.09, 176.71 APE8-dihe-in -102.52, 146.88 APE8-rot-in 304.12 APE67-dihe-in -72.23, -19.95 -36.06, -50.38 APE12-dist-in 12.787 APE11-dist-in 10.674 APE10-dist-in 5.969 APE9-dist-in 3.075 I57V None None XRAY 2.4 0.235 0.248 B 335 326 0 0 0 0 [[39, 324]] 1.0 3w8l Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.3e-69 240.6 1 301 301 174 175 176 178 180 68 81 85 153 155 154 156 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: IHP

Total number of chains: 3
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 9TFXAAAA

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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 CKA1 CSK21_ARATH 9TFYA Q08467 78 409 409.0 IHP:60501 Allosteric Inactive DFGin 7.604 15.915 BLAminus -108.4, 178.04 51.79, 81.61 -94.23, 27.46 296.08, 79.09 -65.65, -28.63 in-in in 9.217 Saltbr-in 2.916 HRD-in -69.94, -45.64 63.74, 12.01 in-in-out SNCiio in-out ActLoopNT-in 2.876 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -124.57, 168.72 APE9-dihe-na 64.77, 160.42 APE8-dihe-in -83.27, 140.98 APE8-rot-out 192.4 APE67-dihe-in -64.49, -16.93 -31.68, -55.99 APE12-dist-in 12.643 APE11-dist-in 10.17 APE10-dist-in 6.236 APE9-dist-in 3.218 None None None XRAY 5.5 0.249 0.267 A 344 332 0 0 0 0 [[110, 395]] 1.0 9tfy Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1
CMGC CKA1 CSK21_ARATH 9TFYB Q08467 78 409 409.0 IHP:60501 Allosteric Inactive DFGin 7.601 15.969 BLAminus -108.43, 178.22 51.24, 81.53 -93.75, 27.33 296.05, 79.14 -65.5, -28.9 in-in in 9.25 Saltbr-in 2.92 HRD-in -69.94, -45.44 63.61, 11.28 in-in-out SNCiio in-out ActLoopNT-in 2.874 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -124.63, 168.96 APE9-dihe-na 64.63, 159.97 APE8-dihe-in -82.76, 141.38 APE8-rot-out 191.85 APE67-dihe-in -64.65, -16.88 -31.71, -55.99 APE12-dist-in 12.71 APE11-dist-in 10.235 APE10-dist-in 6.262 APE9-dist-in 3.204 None None None XRAY 5.5 0.249 0.267 B 344 332 0 0 0 0 [[110, 395]] 1.0 9tfy Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1
CMGC CKA1 CSK21_ARATH 9TFXAAAA Q08467 78 409 409.0 IHP:60501,BEZ:60502 Allosteric,Type1 Active DFGin 7.412 16.216 BLAminus -116.9, -179.78 54.45, 79.6 -92.35, 21.74 295.78, 82.7 -67.49, -22.65 in-in in 9.313 Saltbr-in 2.667 HRD-in -75.85, -47.48 69.59, 11.15 in-in-in SNCiii in-in ActLoopNT-in 2.9 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.14, 168.32 APE9-dihe-na 65.61, 162.34 APE8-dihe-in -89.85, 146.8 APE8-rot-in 303.88 APE67-dihe-in -66.65, -11.26 -41.17, -55.31 APE12-dist-in 12.451 APE11-dist-in 9.879 APE10-dist-in 6.027 APE9-dist-in 3.115 None None None XRAY 1.7 0.21 0.24 AAAA 344 332 0 0 0 0 [[110, 395]] 1.0 9tfx Arabidopsis thaliana CMGC_CKA1_ARATH CMGC 2.6e-65 226.5 1 301 301 245 246 247 249 251 139 152 156 224 226 225 227 285 272 267 266 265 264 263 262 261 185 Casein kinase II subunit alpha-1