Ligand: NVX

Total number of chains: 1
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 100.0% 4UJ1A
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
AGC PRKACA KAPCA_HUMAN 4UJ1A P17612 15 351 351.0 NVX:61351 Type1 Active DFGin 6.2416 14.5472 BLAminus -123.61, -163.8 61.68, 70.56 -93.64, 20.6 271.48, 60.79 -64.78, -20.97 in-in in 9.0378 Saltbr-in 2.5518 HRD-in -90.63, -51.42 73.4, 9.87 in-in-in SNCiii in-in ActLoopNT-in 2.9745 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.01, 158.56 APE9-dihe-na 139.11, -156.28 APE8-dihe-in -125.77, 137.11 APE8-rot-in 295.71 APE67-dihe-in -57.89, -23.24 -51.45, -49.94 APE12-dist-in 8.1202 APE11-dist-in 11.3926 APE10-dist-in 5.8666 APE9-dist-in 3.6245 None TPO198,SEP339 TPO198,SEP339 XRAY 1.768 0.168 0.201 A 351.0 337.0 0 25 25 0 [[44, 298]] 1.0 4uj1 AGC_PRKACA_HUMAN AGC 4.6e-95 323.7 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: NVX

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% 4Z84A
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 4Z84A P00517 15 351 351.0 NVX:60401 Type1 Active DFGin 6.1539 14.585 BLAminus -122.35, -175.47 64.09, 72.13 -88.27, 20.06 271.08, 58.42 -49.77, -31.82 in-in in 9.0164 Saltbr-in 2.7991 HRD-in -96.48, -53.57 76.53, 13.57 in-in-in SNCiii in-in ActLoopNT-in 2.9176 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -155.06, 154.73 APE9-dihe-na 134.03, -158.23 APE8-dihe-in -120.28, 132.43 APE8-rot-in 300.75 APE67-dihe-in -53.91, -23.24 -46.29, -52.23 APE12-dist-in 8.1505 APE11-dist-in 11.5238 APE10-dist-in 5.9254 APE9-dist-in 3.5106 V124A,L174M,Q182K TPO198,SEP339 TPO198,SEP339 XRAY 1.554 0.209 0.234 A 351.0 337.0 0 25 25 0 [[44, 298]] 1.0 4z84 Bos taurus AGC_PRKACA_BOVIN AGC 1.7e-94 321.9 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_HUMAN 4UJ1A P17612 15 351 351.0 NVX:61351 Type1 Active DFGin 6.2416 14.5472 BLAminus -123.61, -163.8 61.68, 70.56 -93.64, 20.6 271.48, 60.79 -64.78, -20.97 in-in in 9.0378 Saltbr-in 2.5518 HRD-in -90.63, -51.42 73.4, 9.87 in-in-in SNCiii in-in ActLoopNT-in 2.9745 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.01, 158.56 APE9-dihe-na 139.11, -156.28 APE8-dihe-in -125.77, 137.11 APE8-rot-in 295.71 APE67-dihe-in -57.89, -23.24 -51.45, -49.94 APE12-dist-in 8.1202 APE11-dist-in 11.3926 APE10-dist-in 5.8666 APE9-dist-in 3.6245 None TPO198,SEP339 TPO198,SEP339 XRAY 1.768 0.168 0.201 A 351.0 337.0 0 25 25 0 [[44, 298]] 1.0 4uj1 Homo sapiens AGC_PRKACA_HUMAN AGC 4.6e-95 323.7 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: NVX

Total number of chains: 1
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 100.0% 4Z84A
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 4Z84A P00517 15 351 351.0 NVX:60401 Type1 Active DFGin 6.1539 14.585 BLAminus -122.35, -175.47 64.09, 72.13 -88.27, 20.06 271.08, 58.42 -49.77, -31.82 in-in in 9.0164 Saltbr-in 2.7991 HRD-in -96.48, -53.57 76.53, 13.57 in-in-in SNCiii in-in ActLoopNT-in 2.9176 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -155.06, 154.73 APE9-dihe-na 134.03, -158.23 APE8-dihe-in -120.28, 132.43 APE8-rot-in 300.75 APE67-dihe-in -53.91, -23.24 -46.29, -52.23 APE12-dist-in 8.1505 APE11-dist-in 11.5238 APE10-dist-in 5.9254 APE9-dist-in 3.5106 V124A,L174M,Q182K TPO198,SEP339 TPO198,SEP339 XRAY 1.554 0.209 0.234 A 351.0 337.0 0 25 25 0 [[44, 298]] 1.0 4z84 Bos taurus AGC_PRKACA_BOVIN AGC 1.7e-94 321.9 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