| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | PRKAA1 | AAPK1_HUMAN | 4REDA | Q13131 | 22 | 360 | 559.0 | No_ligand | No_ligand | Inactive | DFGinter | 7.5867 | 8.7107 | None | -76.34, -39.91 | -91.25, 104.66 | -101.3, 16.59 | 55.39, 86.7 | 124.85, -0.24 | out-out | out | 12.796 | Saltbr-out | 10.996 | HRD-out | -68.9, 144.23 | -138.95, 122.97 | out-out-out | SNCooo | out-out | ActLoopNT-out | 13.0728 | ActLoopCT-out | nonTYR | APEdihe_aanoo | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 59.47 | APE8-rot-out | 66.53 | APE67-dihe-out | -120.17, 127.81 | -69.82, 149.55 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | K52A | None | None | XRAY | 2.95 | 0.233 | 0.277 | A | 351.0 | 326.0 | 13 | 27 | 18 | 9 | [[27, 279]] | 1.0 | 4red | CAMK_PRKAA1_HUMAN | CAMK | 4.9e-89 | 304.1 | 1.0 | 256.0 | 256.0 | 167 | 168 | 169 | 171 | 173 | 56 | 75 | 79 | 147 | 149 | 148 | 150.0 | 207 | 194 | 189 | 188 | 187 | 186 | 185 | 184 | 183 | 105 | 5'-AMP-activated protein kinase catalytic subunit alpha-1 |
| CAMK | PRKAA1 | AAPK1_HUMAN | 4REDB | Q13131 | 22 | 360 | 559.0 | No_ligand | No_ligand | Inactive | DFGinter | 7.5812 | 8.2239 | None | -76.53, -36.41 | -94.12, 106.96 | -98.58, 14.09 | 52.09, 86.12 | 121.55, -8.46 | out-out | out | 12.6686 | Saltbr-out | 11.1794 | HRD-out | -67.54, 143.84 | -139.21, 124.67 | out-out-out | SNCooo | out-out | ActLoopNT-out | 13.1572 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -40.52 | APE8-rot-out | 68.01 | APE67-dihe-in | -131.1, -88.72 | -74.35, 44.8 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | K52A | None | None | XRAY | 2.95 | 0.233 | 0.277 | B | 351.0 | 331.0 | 8 | 27 | 19 | 8 | [[27, 279]] | 1.0 | 4red | CAMK_PRKAA1_HUMAN | CAMK | 4.9e-89 | 304.1 | 1.0 | 256.0 | 256.0 | 167 | 168 | 169 | 171 | 173 | 56 | 75 | 79 | 147 | 149 | 148 | 150.0 | 207 | 194 | 189 | 188 | 187 | 186 | 185 | 184 | 183 | 105 | 5'-AMP-activated protein kinase catalytic subunit alpha-1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | PRKAA1 | AAPK1_HUMAN | 4REDA | Q13131 | 22 | 360 | 559.0 | No_ligand | No_ligand | Inactive | DFGinter | 7.5867 | 8.7107 | None | -76.34, -39.91 | -91.25, 104.66 | -101.3, 16.59 | 55.39, 86.7 | 124.85, -0.24 | out-out | out | 12.796 | Saltbr-out | 10.996 | HRD-out | -68.9, 144.23 | -138.95, 122.97 | out-out-out | SNCooo | out-out | ActLoopNT-out | 13.0728 | ActLoopCT-out | nonTYR | APEdihe_aanoo | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 59.47 | APE8-rot-out | 66.53 | APE67-dihe-out | -120.17, 127.81 | -69.82, 149.55 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | K52A | None | None | XRAY | 2.95 | 0.233 | 0.277 | A | 351.0 | 326.0 | 13 | 27 | 18 | 9 | [[27, 279]] | 1.0 | 4red | Homo sapiens | CAMK_PRKAA1_HUMAN | CAMK | 4.9e-89 | 304.1 | 1.0 | 256.0 | 256.0 | 167 | 168 | 169 | 171 | 173 | 56 | 75 | 79 | 147 | 149 | 148 | 150.0 | 207 | 194 | 189 | 188 | 187 | 186 | 185 | 184 | 183 | 105 | 5'-AMP-activated protein kinase catalytic subunit alpha-1 |
| CAMK | PRKAA1 | AAPK1_HUMAN | 4REDB | Q13131 | 22 | 360 | 559.0 | No_ligand | No_ligand | Inactive | DFGinter | 7.5812 | 8.2239 | None | -76.53, -36.41 | -94.12, 106.96 | -98.58, 14.09 | 52.09, 86.12 | 121.55, -8.46 | out-out | out | 12.6686 | Saltbr-out | 11.1794 | HRD-out | -67.54, 143.84 | -139.21, 124.67 | out-out-out | SNCooo | out-out | ActLoopNT-out | 13.1572 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -40.52 | APE8-rot-out | 68.01 | APE67-dihe-in | -131.1, -88.72 | -74.35, 44.8 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | K52A | None | None | XRAY | 2.95 | 0.233 | 0.277 | B | 351.0 | 331.0 | 8 | 27 | 19 | 8 | [[27, 279]] | 1.0 | 4red | Homo sapiens | CAMK_PRKAA1_HUMAN | CAMK | 4.9e-89 | 304.1 | 1.0 | 256.0 | 256.0 | 167 | 168 | 169 | 171 | 173 | 56 | 75 | 79 | 147 | 149 | 148 | 150.0 | 207 | 194 | 189 | 188 | 187 | 186 | 185 | 184 | 183 | 105 | 5'-AMP-activated protein kinase catalytic subunit alpha-1 |
| 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 |
|---|