| Gene | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CDKL4 | AF-Q5MAI5-K1A | Q5MAI5 | 1 | 294 | 379.0 | No_ligand | No_ligand | Active | DFGin | 6.7113 | 15.3835 | BLAminus | -133.29, 177.44 | 65.78, 59.97 | -75.37, 19.35 | 279.55, 69.15 | -61.71, -35.43 | in-in | in | 8.7418 | Saltbr-in | 2.7679 | HRD-in | -81.63, -45.22 | 62.6, 19.49 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8595 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.68, 171.96 | APE9-dihe-na | 58.57, 140.68 | APE8-dihe-in | -64.03, 135.44 | APE8-rot-in | 301.05 | APE67-dihe-in | -65.26, -22.24 | -45.42, -45.39 | APE12-dist-in | 12.8283 | APE11-dist-in | 10.8029 | APE10-dist-in | 6.2928 | APE9-dist-in | 3.2075 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 294.0 | 294.0 | 0 | 27 | 27 | 0 | [[4, 286]] | 1.0 | AF-Q5MAI5-K1 | CMGC_CDKL4_HUMAN | CMGC | 9.1e-81 | 277.3 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 183 | 170 | 165 | 164 | 163 | 162 | 161 | 160 | 159 | 81 | Cyclin-dependent kinase-like 4 |
| CDKL4 | AF-Q5MAI5-K3A | Q5MAI5 | 1 | 294 | 379.0 | No_ligand | No_ligand | Active | DFGin | 6.5896 | 15.4108 | BLAminus | -127.78, -178.11 | 66.08, 48.32 | -65.6, 11.62 | 278.82, 78.8 | -63.17, -31.0 | in-in | in | 8.4008 | Saltbr-in | 2.7771 | HRD-in | -82.51, -45.23 | 62.5, 13.57 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8513 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.51, 172.59 | APE9-dihe-na | 58.39, 146.32 | APE8-dihe-in | -67.39, 134.97 | APE8-rot-in | 300.33 | APE67-dihe-in | -63.57, -21.81 | -49.99, -42.28 | APE12-dist-in | 12.7119 | APE11-dist-in | 10.618 | APE10-dist-in | 6.2382 | APE9-dist-in | 3.2071 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 294.0 | 294.0 | 0 | 27 | 27 | 0 | [[4, 286]] | 1.0 | AF-Q5MAI5-K3 | CMGC_CDKL4_HUMAN | CMGC | 9.1e-81 | 277.3 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 183 | 170 | 165 | 164 | 163 | 162 | 161 | 160 | 159 | 81 | Cyclin-dependent kinase-like 4 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CDKL4 | CDKL4_HUMAN | AF-Q5MAI5-K1A | Q5MAI5 | 1 | 294 | 379.0 | No_ligand | No_ligand | Active | DFGin | 6.7113 | 15.3835 | BLAminus | -133.29, 177.44 | 65.78, 59.97 | -75.37, 19.35 | 279.55, 69.15 | -61.71, -35.43 | in-in | in | 8.7418 | Saltbr-in | 2.7679 | HRD-in | -81.63, -45.22 | 62.6, 19.49 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8595 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.68, 171.96 | APE9-dihe-na | 58.57, 140.68 | APE8-dihe-in | -64.03, 135.44 | APE8-rot-in | 301.05 | APE67-dihe-in | -65.26, -22.24 | -45.42, -45.39 | APE12-dist-in | 12.8283 | APE11-dist-in | 10.8029 | APE10-dist-in | 6.2928 | APE9-dist-in | 3.2075 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 294.0 | 294.0 | 0 | 27 | 27 | 0 | [[4, 286]] | 1.0 | AF-Q5MAI5-K1 | Homo sapiens | CMGC_CDKL4_HUMAN | CMGC | 9.1e-81 | 277.3 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 183 | 170 | 165 | 164 | 163 | 162 | 161 | 160 | 159 | 81 | Cyclin-dependent kinase-like 4 |
| CDKL4 | CDKL4_HUMAN | AF-Q5MAI5-K3A | Q5MAI5 | 1 | 294 | 379.0 | No_ligand | No_ligand | Active | DFGin | 6.5896 | 15.4108 | BLAminus | -127.78, -178.11 | 66.08, 48.32 | -65.6, 11.62 | 278.82, 78.8 | -63.17, -31.0 | in-in | in | 8.4008 | Saltbr-in | 2.7771 | HRD-in | -82.51, -45.23 | 62.5, 13.57 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8513 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.51, 172.59 | APE9-dihe-na | 58.39, 146.32 | APE8-dihe-in | -67.39, 134.97 | APE8-rot-in | 300.33 | APE67-dihe-in | -63.57, -21.81 | -49.99, -42.28 | APE12-dist-in | 12.7119 | APE11-dist-in | 10.618 | APE10-dist-in | 6.2382 | APE9-dist-in | 3.2071 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 294.0 | 294.0 | 0 | 27 | 27 | 0 | [[4, 286]] | 1.0 | AF-Q5MAI5-K3 | Homo sapiens | CMGC_CDKL4_HUMAN | CMGC | 9.1e-81 | 277.3 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 183 | 170 | 165 | 164 | 163 | 162 | 161 | 160 | 159 | 81 | Cyclin-dependent kinase-like 4 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| 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 |
|---|