| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CDK1 | CDK1_HUMAN | 9SKQA | P06493 | 3 | 288 | 297.0 | ANP:60301 | ATPlike | Inactive | DFGin | 7.1434 | 16.0323 | BLAminus | -125.06, -177.1 | 57.55, 62.82 | -86.84, 50.52 | 271.32, 82.93 | -98.1, -26.9 | in-out | in | 9.7163 | Saltbr-out | 5.762 | HRD-in | -83.48, -58.42 | 64.77, 13.47 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6846 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_iiii | APE10-dihe-na | -142.74, 165.15 | APE9-dihe-na | 69.23, -36.98 | APE8-dihe-out | 60.52, 63.14 | APE8-rot-out | 73.99 | APE67-dihe-out | 57.27, -80.66 | 61.32, -166.6 | APE12-dist-in | 12.7031 | APE11-dist-in | 10.0266 | APE10-dist-in | 7.0709 | APE9-dist-in | 3.7308 | None | TPO161 | TPO161 | EM | 3.4 | 999.0 | 999.0 | A | 302.0 | 286.0 | 0 | 28 | 28 | 0 | [[4, 287]] | 1.0 | 9skq | CMGC_CDK1_HUMAN | CMGC | 2.7e-87 | 298.9 | 1.0 | 301.0 | 301.0 | 145 | 146 | 147 | 149 | 151 | 33 | 51 | 55 | 125 | 127 | 126 | 128.0 | 186 | 173 | 168 | 167 | 166 | 165 | 164 | 163 | 162 | 81 | Cyclin-dependent kinase 1 |
| CMGC | CDK7 | CDK7_HUMAN | 9SKQJ | P50613 | 9 | 346 | 346.0 | ANP:60401 | ATPlike | Inactive | DFGin | 7.0888 | 16.0793 | BLAminus | -134.4, -172.6 | 54.33, 63.76 | -84.59, 21.04 | 273.82, 84.09 | -68.06, -13.54 | in-out | in | 8.6851 | Saltbr-out | 3.6038 | HRD-in | -66.63, -50.41 | 66.76, -1.97 | out-in-out | SNCoio | in-out | ActLoopNT-in | 3.0208 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -107.15, 155.19 | APE9-dihe-na | -64.85, 155.06 | APE8-dihe-in | -50.04, 149.57 | APE8-rot-out | 168.49 | APE67-dihe-in | -67.74, -34.69 | -63.59, -17.75 | APE12-dist-in | 10.5875 | APE11-dist-out | 5.6701 | APE10-dist-out | 9.403 | APE9-dist-in | 3.9875 | None | None | None | EM | 3.4 | 999.0 | 999.0 | J | 391.0 | 306.0 | 0 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 9skq | CMGC_CDK7_HUMAN | CMGC | 2.4e-78 | 271.1 | 1.0 | 301.0 | 301.0 | 154 | 155 | 156 | 158 | 160 | 41 | 62 | 66 | 134 | 136 | 135 | 137.0 | 195 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Cyclin-dependent kinase 7 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CDK1 | CDK1_HUMAN | 9SKQA | P06493 | 3 | 288 | 297.0 | ANP:60301 | ATPlike | Inactive | DFGin | 7.1434 | 16.0323 | BLAminus | -125.06, -177.1 | 57.55, 62.82 | -86.84, 50.52 | 271.32, 82.93 | -98.1, -26.9 | in-out | in | 9.7163 | Saltbr-out | 5.762 | HRD-in | -83.48, -58.42 | 64.77, 13.47 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6846 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_iiii | APE10-dihe-na | -142.74, 165.15 | APE9-dihe-na | 69.23, -36.98 | APE8-dihe-out | 60.52, 63.14 | APE8-rot-out | 73.99 | APE67-dihe-out | 57.27, -80.66 | 61.32, -166.6 | APE12-dist-in | 12.7031 | APE11-dist-in | 10.0266 | APE10-dist-in | 7.0709 | APE9-dist-in | 3.7308 | None | TPO161 | TPO161 | EM | 3.4 | 999.0 | 999.0 | A | 302.0 | 286.0 | 0 | 28 | 28 | 0 | [[4, 287]] | 1.0 | 9skq | Homo sapiens | CMGC_CDK1_HUMAN | CMGC | 2.7e-87 | 298.9 | 1.0 | 301.0 | 301.0 | 145 | 146 | 147 | 149 | 151 | 33 | 51 | 55 | 125 | 127 | 126 | 128.0 | 186 | 173 | 168 | 167 | 166 | 165 | 164 | 163 | 162 | 81 | Cyclin-dependent kinase 1 |
| CMGC | CDK7 | CDK7_HUMAN | 9SKQJ | P50613 | 9 | 346 | 346.0 | ANP:60401 | ATPlike | Inactive | DFGin | 7.0888 | 16.0793 | BLAminus | -134.4, -172.6 | 54.33, 63.76 | -84.59, 21.04 | 273.82, 84.09 | -68.06, -13.54 | in-out | in | 8.6851 | Saltbr-out | 3.6038 | HRD-in | -66.63, -50.41 | 66.76, -1.97 | out-in-out | SNCoio | in-out | ActLoopNT-in | 3.0208 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -107.15, 155.19 | APE9-dihe-na | -64.85, 155.06 | APE8-dihe-in | -50.04, 149.57 | APE8-rot-out | 168.49 | APE67-dihe-in | -67.74, -34.69 | -63.59, -17.75 | APE12-dist-in | 10.5875 | APE11-dist-out | 5.6701 | APE10-dist-out | 9.403 | APE9-dist-in | 3.9875 | None | None | None | EM | 3.4 | 999.0 | 999.0 | J | 391.0 | 306.0 | 0 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 9skq | Homo sapiens | CMGC_CDK7_HUMAN | CMGC | 2.4e-78 | 271.1 | 1.0 | 301.0 | 301.0 | 154 | 155 | 156 | 158 | 160 | 41 | 62 | 66 | 134 | 136 | 135 | 137.0 | 195 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Cyclin-dependent kinase 7 |
| 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 |
|---|