| 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 | 8B54A | P24941 | 1 | 294 | 298.0 | P2V:301 | Type1 | Inactive | DFGin | 6.514 | 15.247 | BLAminus | -128.12, 170.62 | 59.1, 85.13 | -100.08, 22.73 | 286.24, 67.7 | -63.02, -30.99 | in-in | in | 8.487 | Saltbr-in | 2.815 | HRD-in | -82.86, -54.52 | 68.83, 22.28 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.055 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -99.69, 158.44 | APE9-dihe-na | 80.04, 135.87 | APE8-dihe-in | -60.84, 136.8 | APE8-rot-out | 36.15 | APE67-dihe-in | -51.66, -27.71 | -44.78, -57.24 | APE12-dist-in | 13.431 | APE11-dist-in | 12.01 | APE10-dist-in | 7.248 | APE9-dist-in | 3.365 | None | TPO160 | TPO160 | XRAY | 2.6 | 0.234 | 0.287 | A | 299 | 292 | 2 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 8b54 | CMGC_CDK2_HUMAN | CMGC | 6.4e-90 | 307.8 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK2 | CDK2_HUMAN | 8B54C | P24941 | 1 | 294 | 298.0 | P2V:302 | Type1 | Active | DFGin | 6.514 | 15.099 | BLAminus | -122.54, 172.83 | 60.19, 84.09 | -98.1, 19.4 | 281.6, 70.02 | -54.41, -41.26 | in-in | in | 8.374 | Saltbr-in | 2.81 | HRD-in | -75.35, -55.92 | 72.59, 17.93 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.874 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -80.35, 158.96 | APE9-dihe-na | 82.94, 134.61 | APE8-dihe-in | -57.65, 133.89 | APE8-rot-in | 307.69 | APE67-dihe-in | -50.27, -27.61 | -42.77, -59.14 | APE12-dist-in | 13.319 | APE11-dist-in | 12.023 | APE10-dist-in | 7.065 | APE9-dist-in | 3.348 | None | TPO160 | TPO160 | XRAY | 2.6 | 0.234 | 0.287 | C | 299 | 292 | 2 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 8b54 | CMGC_CDK2_HUMAN | CMGC | 6.4e-90 | 307.8 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 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 | 8B54A | P24941 | 1 | 294 | 298.0 | P2V:301 | Type1 | Inactive | DFGin | 6.514 | 15.247 | BLAminus | -128.12, 170.62 | 59.1, 85.13 | -100.08, 22.73 | 286.24, 67.7 | -63.02, -30.99 | in-in | in | 8.487 | Saltbr-in | 2.815 | HRD-in | -82.86, -54.52 | 68.83, 22.28 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.055 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -99.69, 158.44 | APE9-dihe-na | 80.04, 135.87 | APE8-dihe-in | -60.84, 136.8 | APE8-rot-out | 36.15 | APE67-dihe-in | -51.66, -27.71 | -44.78, -57.24 | APE12-dist-in | 13.431 | APE11-dist-in | 12.01 | APE10-dist-in | 7.248 | APE9-dist-in | 3.365 | None | TPO160 | TPO160 | XRAY | 2.6 | 0.234 | 0.287 | A | 299 | 292 | 2 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 8b54 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.4e-90 | 307.8 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK2 | CDK2_HUMAN | 8B54C | P24941 | 1 | 294 | 298.0 | P2V:302 | Type1 | Active | DFGin | 6.514 | 15.099 | BLAminus | -122.54, 172.83 | 60.19, 84.09 | -98.1, 19.4 | 281.6, 70.02 | -54.41, -41.26 | in-in | in | 8.374 | Saltbr-in | 2.81 | HRD-in | -75.35, -55.92 | 72.59, 17.93 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.874 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -80.35, 158.96 | APE9-dihe-na | 82.94, 134.61 | APE8-dihe-in | -57.65, 133.89 | APE8-rot-in | 307.69 | APE67-dihe-in | -50.27, -27.61 | -42.77, -59.14 | APE12-dist-in | 13.319 | APE11-dist-in | 12.023 | APE10-dist-in | 7.065 | APE9-dist-in | 3.348 | None | TPO160 | TPO160 | XRAY | 2.6 | 0.234 | 0.287 | C | 299 | 292 | 2 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 8b54 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.4e-90 | 307.8 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 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 |
|---|