| 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 | 5IZJA | P17612 | 15 | 351 | 351.0 | 6J9:60414 | Allosteric | Inactive | DFGin | 6.0059 | 14.882 | BLAminus | -111.62, 172.78 | 70.98, 87.77 | -97.8, 27.11 | 278.83, 80.41 | -58.58, -30.48 | in-out | in | 9.9394 | Saltbr-out | 4.1818 | HRD-in | -81.12, -50.89 | 44.27, 35.23 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9865 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -140.79, 157.34 | APE9-dihe-na | 106.02, 164.59 | APE8-dihe-in | -74.04, 136.38 | APE8-rot-out | 204.5 | APE67-dihe-in | -57.37, -26.41 | -46.69, -44.98 | APE12-dist-in | 8.2021 | APE11-dist-in | 11.523 | APE10-dist-in | 5.7985 | APE9-dist-in | 4.2246 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 1.85 | 0.199 | 0.226 | A | 351.0 | 330.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 5izj | 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 |
| AGC | PRKACA | KAPCA_HUMAN | 5IZJB | P17612 | 15 | 351 | 351.0 | 6J9:60413 | Allosteric | Inactive | DFGin | 6.2012 | 15.2736 | BLAminus | -109.02, 168.97 | 75.33, 87.97 | -97.67, 24.22 | 269.13, 57.46 | -63.02, -24.98 | out-out | out | 10.2894 | Saltbr-out | 4.5426 | HRD-in | -78.48, -51.65 | 67.16, 12.35 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9093 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -144.15, 157.15 | APE9-dihe-na | 105.13, 166.26 | APE8-dihe-in | -75.85, 137.43 | APE8-rot-out | 200.52 | APE67-dihe-in | -61.79, -25.86 | -47.32, -41.18 | APE12-dist-in | 8.2568 | APE11-dist-in | 11.4828 | APE10-dist-in | 5.8129 | APE9-dist-in | 4.0688 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 1.85 | 0.199 | 0.226 | B | 351.0 | 327.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 5izj | 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 |
| 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_HUMAN | 5IZJA | P17612 | 15 | 351 | 351.0 | 6J9:60414 | Allosteric | Inactive | DFGin | 6.0059 | 14.882 | BLAminus | -111.62, 172.78 | 70.98, 87.77 | -97.8, 27.11 | 278.83, 80.41 | -58.58, -30.48 | in-out | in | 9.9394 | Saltbr-out | 4.1818 | HRD-in | -81.12, -50.89 | 44.27, 35.23 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9865 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -140.79, 157.34 | APE9-dihe-na | 106.02, 164.59 | APE8-dihe-in | -74.04, 136.38 | APE8-rot-out | 204.5 | APE67-dihe-in | -57.37, -26.41 | -46.69, -44.98 | APE12-dist-in | 8.2021 | APE11-dist-in | 11.523 | APE10-dist-in | 5.7985 | APE9-dist-in | 4.2246 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 1.85 | 0.199 | 0.226 | A | 351.0 | 330.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 5izj | 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 |
| AGC | PRKACA | KAPCA_HUMAN | 5IZJB | P17612 | 15 | 351 | 351.0 | 6J9:60413 | Allosteric | Inactive | DFGin | 6.2012 | 15.2736 | BLAminus | -109.02, 168.97 | 75.33, 87.97 | -97.67, 24.22 | 269.13, 57.46 | -63.02, -24.98 | out-out | out | 10.2894 | Saltbr-out | 4.5426 | HRD-in | -78.48, -51.65 | 67.16, 12.35 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9093 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -144.15, 157.15 | APE9-dihe-na | 105.13, 166.26 | APE8-dihe-in | -75.85, 137.43 | APE8-rot-out | 200.52 | APE67-dihe-in | -61.79, -25.86 | -47.32, -41.18 | APE12-dist-in | 8.2568 | APE11-dist-in | 11.4828 | APE10-dist-in | 5.8129 | APE9-dist-in | 4.0688 | None | TPO198,SEP339 | TPO198,SEP339 | XRAY | 1.85 | 0.199 | 0.226 | B | 351.0 | 327.0 | 0 | 25 | 25 | 0 | [[44, 298]] | 1.0 | 5izj | 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 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| 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 |
|---|