| 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 | CDK2 | CDK2_HUMAN | 9QCXK | P24941 | 1 | 292 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.7189 | 16.0414 | BLAminus | -144.83, 178.78 | 57.4, 64.51 | -84.56, 50.23 | 281.94, 71.88 | -85.61, -30.32 | in-in | in | 9.2703 | Saltbr-in | 3.2363 | HRD-in | -67.06, -51.02 | 68.85, 2.16 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.5952 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -167.43, 154.34 | APE9-dihe-na | -64.57, 162.43 | APE8-dihe-in | -64.83, 167.28 | APE8-rot-out | 196.35 | APE67-dihe-in | -64.39, -23.47 | -61.67, -44.4 | APE12-dist-in | 10.9366 | APE11-dist-out | 5.9634 | APE10-dist-out | 8.9488 | APE9-dist-in | 3.98 | None | None | None | EM | 2.6 | 999.0 | 999.0 | K | 301.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9qcx | CMGC_CDK2_HUMAN | CMGC | 6.6e-90 | 307.8 | 1.0 | 301.0 | 301.0 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127.0 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK7 | CDK7_HUMAN | 9QCXJ | P50613 | 9 | 346 | 346.0 | No_ligand | No_ligand | Inactive | DFGin | 6.6963 | 16.0265 | BLAminus | -131.02, -177.03 | 59.81, 66.92 | -86.78, 26.87 | 276.81, 73.59 | -75.67, -10.97 | in-out | in | 8.7931 | Saltbr-out | 3.9707 | HRD-in | -71.21, -46.31 | 66.3, 0.75 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7535 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -103.75, 161.28 | APE9-dihe-na | -68.95, 168.1 | APE8-dihe-in | -56.3, 142.34 | APE8-rot-out | 173.25 | APE67-dihe-in | -65.83, -25.32 | -64.61, -15.36 | APE12-dist-in | 10.4856 | APE11-dist-out | 5.5683 | APE10-dist-out | 9.089 | APE9-dist-in | 3.8595 | None | None | None | EM | 2.6 | 999.0 | 999.0 | J | 391.0 | 309.0 | 0 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 9qcx | 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 | CDK2 | CDK2_HUMAN | 9QCXK | P24941 | 1 | 292 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.7189 | 16.0414 | BLAminus | -144.83, 178.78 | 57.4, 64.51 | -84.56, 50.23 | 281.94, 71.88 | -85.61, -30.32 | in-in | in | 9.2703 | Saltbr-in | 3.2363 | HRD-in | -67.06, -51.02 | 68.85, 2.16 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.5952 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -167.43, 154.34 | APE9-dihe-na | -64.57, 162.43 | APE8-dihe-in | -64.83, 167.28 | APE8-rot-out | 196.35 | APE67-dihe-in | -64.39, -23.47 | -61.67, -44.4 | APE12-dist-in | 10.9366 | APE11-dist-out | 5.9634 | APE10-dist-out | 8.9488 | APE9-dist-in | 3.98 | None | None | None | EM | 2.6 | 999.0 | 999.0 | K | 301.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9qcx | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.6e-90 | 307.8 | 1.0 | 301.0 | 301.0 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127.0 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK7 | CDK7_HUMAN | 9QCXJ | P50613 | 9 | 346 | 346.0 | No_ligand | No_ligand | Inactive | DFGin | 6.6963 | 16.0265 | BLAminus | -131.02, -177.03 | 59.81, 66.92 | -86.78, 26.87 | 276.81, 73.59 | -75.67, -10.97 | in-out | in | 8.7931 | Saltbr-out | 3.9707 | HRD-in | -71.21, -46.31 | 66.3, 0.75 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7535 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -103.75, 161.28 | APE9-dihe-na | -68.95, 168.1 | APE8-dihe-in | -56.3, 142.34 | APE8-rot-out | 173.25 | APE67-dihe-in | -65.83, -25.32 | -64.61, -15.36 | APE12-dist-in | 10.4856 | APE11-dist-out | 5.5683 | APE10-dist-out | 9.089 | APE9-dist-in | 3.8595 | None | None | None | EM | 2.6 | 999.0 | 999.0 | J | 391.0 | 309.0 | 0 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 9qcx | 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 |
|---|