| 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 | CDK7 | CDK7_HUMAN | 8PYRA | P50613 | 46 | 311 | 346.0 | No_ligand | No_ligand | Inactive | None | 6.5429 | 999.0 | None | -122.94, -68.2 | -80.73, 102.32 | -98.18, 22.66 | 281.33, 69.82 | -69.91, -16.7 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -77.35, -47.6 | 64.82, 19.19 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8299 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -123.11, 167.33 | APE9-dihe-na | 68.76, 128.67 | APE8-dihe-in | -52.64, 137.07 | APE8-rot-in | 303.34 | APE67-dihe-in | -60.29, -22.26 | -49.6, -45.66 | APE12-dist-in | 12.8695 | APE11-dist-in | 10.8601 | APE10-dist-in | 6.3576 | APE9-dist-in | 3.203 | None | SEP164,TPO170 | SEP164,TPO170 | XRAY | 2.15 | 0.223 | 0.241 | A | 346.0 | 266.0 | 34 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 8pyr | CMGC_CDK7_HUMAN | CMGC | 1.6e-78 | 271.8 | 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 |
| CMGC | CDK7 | CDK7_HUMAN | 8PYRE | P50613 | 51 | 310 | 346.0 | No_ligand | No_ligand | Inactive | None | 6.5118 | 999.0 | None | -129.77, -168.82 | 32.02, 94.76 | -100.83, 24.77 | 279.75, 68.97 | -67.87, -15.59 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -77.49, -47.54 | 64.99, 19.99 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8158 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -122.08, 166.13 | APE9-dihe-na | 67.89, 131.66 | APE8-dihe-in | -53.3, 135.79 | APE8-rot-in | 302.92 | APE67-dihe-in | -59.26, -22.23 | -50.11, -44.65 | APE12-dist-in | 12.8711 | APE11-dist-in | 10.7517 | APE10-dist-in | 6.3624 | APE9-dist-in | 3.1483 | None | SEP164,TPO170 | SEP164,TPO170 | XRAY | 2.15 | 0.223 | 0.241 | E | 346.0 | 260.0 | 39 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 8pyr | CMGC_CDK7_HUMAN | CMGC | 1.6e-78 | 271.8 | 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 | CDK7 | CDK7_HUMAN | 8PYRA | P50613 | 46 | 311 | 346.0 | No_ligand | No_ligand | Inactive | None | 6.5429 | 999.0 | None | -122.94, -68.2 | -80.73, 102.32 | -98.18, 22.66 | 281.33, 69.82 | -69.91, -16.7 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -77.35, -47.6 | 64.82, 19.19 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8299 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -123.11, 167.33 | APE9-dihe-na | 68.76, 128.67 | APE8-dihe-in | -52.64, 137.07 | APE8-rot-in | 303.34 | APE67-dihe-in | -60.29, -22.26 | -49.6, -45.66 | APE12-dist-in | 12.8695 | APE11-dist-in | 10.8601 | APE10-dist-in | 6.3576 | APE9-dist-in | 3.203 | None | SEP164,TPO170 | SEP164,TPO170 | XRAY | 2.15 | 0.223 | 0.241 | A | 346.0 | 266.0 | 34 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 8pyr | Homo sapiens | CMGC_CDK7_HUMAN | CMGC | 1.6e-78 | 271.8 | 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 |
| CMGC | CDK7 | CDK7_HUMAN | 8PYRE | P50613 | 51 | 310 | 346.0 | No_ligand | No_ligand | Inactive | None | 6.5118 | 999.0 | None | -129.77, -168.82 | 32.02, 94.76 | -100.83, 24.77 | 279.75, 68.97 | -67.87, -15.59 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-in | -77.49, -47.54 | 64.99, 19.99 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8158 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -122.08, 166.13 | APE9-dihe-na | 67.89, 131.66 | APE8-dihe-in | -53.3, 135.79 | APE8-rot-in | 302.92 | APE67-dihe-in | -59.26, -22.23 | -50.11, -44.65 | APE12-dist-in | 12.8711 | APE11-dist-in | 10.7517 | APE10-dist-in | 6.3624 | APE9-dist-in | 3.1483 | None | SEP164,TPO170 | SEP164,TPO170 | XRAY | 2.15 | 0.223 | 0.241 | E | 346.0 | 260.0 | 39 | 28 | 28 | 0 | [[12, 295]] | 1.0 | 8pyr | Homo sapiens | CMGC_CDK7_HUMAN | CMGC | 1.6e-78 | 271.8 | 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 |
|---|