| 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 | 6SG4A | P24941 | 28 | 294 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.287 | 15.2716 | BLAminus | -142.64, -177.22 | 52.35, 74.31 | -90.44, 26.74 | 283.94, 75.05 | -68.52, -27.31 | in-out | in | 8.3281 | Saltbr-out | 3.8364 | HRD-in | -89.89, -55.83 | 73.82, 12.09 | out-in-in | SNCoii | in-in | ActLoopNT-in | 3.0942 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -97.38, 167.08 | APE9-dihe-na | 73.43, 135.34 | APE8-dihe-in | -50.66, 135.8 | APE8-rot-in | 300.95 | APE67-dihe-in | -63.18, -27.15 | -46.65, -49.09 | APE12-dist-in | 13.4762 | APE11-dist-in | 12.3585 | APE10-dist-in | 7.2969 | APE9-dist-in | 3.2213 | None | TPO160 | TPO160 | XRAY | 2.43 | 0.203 | 0.251 | A | 302.0 | 262.0 | 29 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6sg4 | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | CDK2 | CDK2_HUMAN | 6SG4C | P24941 | 29 | 295 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.2669 | 16.249 | BLAminus | -137.43, 175.83 | 54.02, 83.17 | -94.69, 27.17 | 280.38, 64.22 | -59.95, -51.33 | out-out | out | 13.669 | Saltbr-out | 13.3386 | HRD-in | -70.61, -65.73 | 80.25, 9.94 | out-in-in | SNCoii | in-in | ActLoopNT-in | 3.1131 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.33, -55.22 | APE9-dihe-na | -67.84, 151.02 | APE8-dihe-in | -58.58, 141.84 | APE8-rot-in | 311.32 | APE67-dihe-in | -64.58, -30.99 | -51.04, -45.77 | APE12-dist-in | 13.4802 | APE11-dist-in | 12.2516 | APE10-dist-in | 6.8302 | APE9-dist-in | 3.5368 | None | TPO160 | TPO160 | XRAY | 2.43 | 0.203 | 0.251 | C | 302.0 | 261.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6sg4 | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 |
| 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 | 6SG4A | P24941 | 28 | 294 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.287 | 15.2716 | BLAminus | -142.64, -177.22 | 52.35, 74.31 | -90.44, 26.74 | 283.94, 75.05 | -68.52, -27.31 | in-out | in | 8.3281 | Saltbr-out | 3.8364 | HRD-in | -89.89, -55.83 | 73.82, 12.09 | out-in-in | SNCoii | in-in | ActLoopNT-in | 3.0942 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -97.38, 167.08 | APE9-dihe-na | 73.43, 135.34 | APE8-dihe-in | -50.66, 135.8 | APE8-rot-in | 300.95 | APE67-dihe-in | -63.18, -27.15 | -46.65, -49.09 | APE12-dist-in | 13.4762 | APE11-dist-in | 12.3585 | APE10-dist-in | 7.2969 | APE9-dist-in | 3.2213 | None | TPO160 | TPO160 | XRAY | 2.43 | 0.203 | 0.251 | A | 302.0 | 262.0 | 29 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6sg4 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | CDK2 | CDK2_HUMAN | 6SG4C | P24941 | 29 | 295 | 298.0 | No_ligand | No_ligand | Inactive | DFGin | 6.2669 | 16.249 | BLAminus | -137.43, 175.83 | 54.02, 83.17 | -94.69, 27.17 | 280.38, 64.22 | -59.95, -51.33 | out-out | out | 13.669 | Saltbr-out | 13.3386 | HRD-in | -70.61, -65.73 | 80.25, 9.94 | out-in-in | SNCoii | in-in | ActLoopNT-in | 3.1131 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.33, -55.22 | APE9-dihe-na | -67.84, 151.02 | APE8-dihe-in | -58.58, 141.84 | APE8-rot-in | 311.32 | APE67-dihe-in | -64.58, -30.99 | -51.04, -45.77 | APE12-dist-in | 13.4802 | APE11-dist-in | 12.2516 | APE10-dist-in | 6.8302 | APE9-dist-in | 3.5368 | None | TPO160 | TPO160 | XRAY | 2.43 | 0.203 | 0.251 | C | 302.0 | 261.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6sg4 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 |
| 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 |
|---|