Ligand: R68

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 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

Ligand: R68

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% 1XH5A
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
AGC PRKACA KAPCA_BOVIN 1XH5A P00517 15 351 351.0 R68:61001 Type1 Active DFGin 6.3947 13.2316 BLAminus -125.11, 175.33 63.85, 75.87 -93.6, 21.14 294.45, 75.91 -54.91, -25.56 in-in in 8.7353 Saltbr-in 2.7377 HRD-in -92.22, -50.1 68.22, 14.89 in-in-in SNCiii in-in ActLoopNT-in 2.9658 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.82, 159.18 APE9-dihe-na 129.26, -172.93 APE8-dihe-in -106.77, 134.87 APE8-rot-in 299.04 APE67-dihe-in -60.66, -25.82 -46.87, -48.0 APE12-dist-in 7.9509 APE11-dist-in 11.4133 APE10-dist-in 5.881 APE9-dist-in 3.5909 None TPO198,SEP339 TPO198,SEP339 XRAY 2.05 0.185 0.236 A 350.0 337.0 0 25 25 0 [[44, 298]] 1.0 1xh5 Bos taurus AGC_PRKACA_BOVIN AGC 1.3e-94 322.2 1.0 260.0 260.0 184 185 186 188 190 73 92 96 164 166 165 167.0 221 209 204 203 202 201 200 199 198 122 cAMP-dependent protein kinase catalytic subunit alpha
AGC PRKACA KAPCA_BOVIN 1XHAA P00517 2 351 351.0 R68:61001 Type1 Active DFGin 6.2641 14.1375 BLAminus -120.5, -174.91 64.53, 71.29 -89.72, 23.88 279.31, 73.73 -56.55, -38.89 in-in in 8.7371 Saltbr-in 2.545 HRD-in -89.15, -49.54 68.47, 12.55 in-in-in SNCiii in-in ActLoopNT-in 2.9376 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.3, 164.66 APE9-dihe-na 127.73, 179.02 APE8-dihe-in -85.45, 132.2 APE8-rot-in 302.59 APE67-dihe-in -55.5, -36.01 -41.3, -53.29 APE12-dist-in 8.4646 APE11-dist-in 11.7786 APE10-dist-in 6.157 APE9-dist-in 3.7469 Q85E,V124A,L174M,F188L TPO198,SEP339 TPO198,SEP339 XRAY 2.46 0.223 0.272 A 350.0 350.0 0 25 25 0 [[44, 298]] 1.0 1xha Bos taurus AGC_PRKACA_BOVIN AGC 3e-94 321.0 1.0 260.0 260.0 184 185 186 188 190 73 92 96 164 166 165 167.0 221 209 204 203 202 201 200 199 198 122 cAMP-dependent protein kinase catalytic subunit alpha

Ligand: R68

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% 1XH5A
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
AGC PRKACA KAPCA_BOVIN 1XH5A P00517 15 351 351.0 R68:61001 Type1 Active DFGin 6.3947 13.2316 BLAminus -125.11, 175.33 63.85, 75.87 -93.6, 21.14 294.45, 75.91 -54.91, -25.56 in-in in 8.7353 Saltbr-in 2.7377 HRD-in -92.22, -50.1 68.22, 14.89 in-in-in SNCiii in-in ActLoopNT-in 2.9658 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.82, 159.18 APE9-dihe-na 129.26, -172.93 APE8-dihe-in -106.77, 134.87 APE8-rot-in 299.04 APE67-dihe-in -60.66, -25.82 -46.87, -48.0 APE12-dist-in 7.9509 APE11-dist-in 11.4133 APE10-dist-in 5.881 APE9-dist-in 3.5909 None TPO198,SEP339 TPO198,SEP339 XRAY 2.05 0.185 0.236 A 350.0 337.0 0 25 25 0 [[44, 298]] 1.0 1xh5 Bos taurus AGC_PRKACA_BOVIN AGC 1.3e-94 322.2 1.0 260.0 260.0 184 185 186 188 190 73 92 96 164 166 165 167.0 221 209 204 203 202 201 200 199 198 122 cAMP-dependent protein kinase catalytic subunit alpha
AGC PRKACA KAPCA_BOVIN 1XHAA P00517 2 351 351.0 R68:61001 Type1 Active DFGin 6.2641 14.1375 BLAminus -120.5, -174.91 64.53, 71.29 -89.72, 23.88 279.31, 73.73 -56.55, -38.89 in-in in 8.7371 Saltbr-in 2.545 HRD-in -89.15, -49.54 68.47, 12.55 in-in-in SNCiii in-in ActLoopNT-in 2.9376 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.3, 164.66 APE9-dihe-na 127.73, 179.02 APE8-dihe-in -85.45, 132.2 APE8-rot-in 302.59 APE67-dihe-in -55.5, -36.01 -41.3, -53.29 APE12-dist-in 8.4646 APE11-dist-in 11.7786 APE10-dist-in 6.157 APE9-dist-in 3.7469 Q85E,V124A,L174M,F188L TPO198,SEP339 TPO198,SEP339 XRAY 2.46 0.223 0.272 A 350.0 350.0 0 25 25 0 [[44, 298]] 1.0 1xha Bos taurus AGC_PRKACA_BOVIN AGC 3e-94 321.0 1.0 260.0 260.0 184 185 186 188 190 73 92 96 164 166 165 167.0 221 209 204 203 202 201 200 199 198 122 cAMP-dependent protein kinase catalytic subunit alpha