| 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 | 4EORA | P24941 | 1 | 297 | 298.0 | 4SP:60301 | Type1 | Inactive | DFGin | 6.8817 | 15.0327 | BLAminus | -134.35, 175.73 | 52.6, 78.13 | -90.64, 21.49 | 277.96, 74.78 | -65.84, -25.49 | in-out | in | 8.3967 | Saltbr-out | 4.4145 | HRD-in | -78.57, -52.47 | 67.64, 16.68 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8849 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -52.36, 151.62 | APE9-dihe-na | 75.68, 126.45 | APE8-dihe-in | -53.52, 134.61 | APE8-rot-in | 299.42 | APE67-dihe-in | -64.87, -24.77 | -45.32, -44.73 | APE12-dist-in | 13.3161 | APE11-dist-in | 9.4861 | APE10-dist-in | 7.2678 | APE9-dist-in | 3.3382 | None | TPO160 | TPO160 | XRAY | 2.2 | 0.222 | 0.245 | A | 298.0 | 293.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eor | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 4EORC | P24941 | 1 | 294 | 298.0 | 4SP:60301 | Type1 | Inactive | DFGin | 6.7811 | 14.9498 | BLAminus | -138.63, 178.48 | 45.83, 76.13 | -84.97, 25.42 | 283.82, 70.0 | -63.08, -30.05 | in-in | in | 8.5446 | Saltbr-in | 2.7047 | HRD-in | -80.46, -52.24 | 65.94, 14.93 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0301 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -129.75, 149.39 | APE9-dihe-na | 67.36, 128.22 | APE8-dihe-in | -66.22, 148.97 | APE8-rot-out | 182.23 | APE67-dihe-in | -56.76, -22.19 | -48.62, -53.23 | APE12-dist-in | 12.8885 | APE11-dist-in | 9.8402 | APE10-dist-in | 7.0247 | APE9-dist-in | 3.2199 | None | TPO160 | TPO160 | XRAY | 2.2 | 0.222 | 0.245 | C | 298.0 | 270.0 | 24 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eor | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 4EORA | P24941 | 1 | 297 | 298.0 | 4SP:60301 | Type1 | Inactive | DFGin | 6.8817 | 15.0327 | BLAminus | -134.35, 175.73 | 52.6, 78.13 | -90.64, 21.49 | 277.96, 74.78 | -65.84, -25.49 | in-out | in | 8.3967 | Saltbr-out | 4.4145 | HRD-in | -78.57, -52.47 | 67.64, 16.68 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.8849 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -52.36, 151.62 | APE9-dihe-na | 75.68, 126.45 | APE8-dihe-in | -53.52, 134.61 | APE8-rot-in | 299.42 | APE67-dihe-in | -64.87, -24.77 | -45.32, -44.73 | APE12-dist-in | 13.3161 | APE11-dist-in | 9.4861 | APE10-dist-in | 7.2678 | APE9-dist-in | 3.3382 | None | TPO160 | TPO160 | XRAY | 2.2 | 0.222 | 0.245 | A | 298.0 | 293.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eor | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 4EORC | P24941 | 1 | 294 | 298.0 | 4SP:60301 | Type1 | Inactive | DFGin | 6.7811 | 14.9498 | BLAminus | -138.63, 178.48 | 45.83, 76.13 | -84.97, 25.42 | 283.82, 70.0 | -63.08, -30.05 | in-in | in | 8.5446 | Saltbr-in | 2.7047 | HRD-in | -80.46, -52.24 | 65.94, 14.93 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0301 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -129.75, 149.39 | APE9-dihe-na | 67.36, 128.22 | APE8-dihe-in | -66.22, 148.97 | APE8-rot-out | 182.23 | APE67-dihe-in | -56.76, -22.19 | -48.62, -53.23 | APE12-dist-in | 12.8885 | APE11-dist-in | 9.8402 | APE10-dist-in | 7.0247 | APE9-dist-in | 3.2199 | None | TPO160 | TPO160 | XRAY | 2.2 | 0.222 | 0.245 | C | 298.0 | 270.0 | 24 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eor | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 |
|---|