| 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 | 1H26A | P24941 | 1 | 297 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.7068 | 15.2308 | BLAminus | -130.74, 179.93 | 49.99, 80.78 | -90.99, 22.63 | 278.59, 67.54 | -55.88, -33.36 | in-in | in | 8.5127 | Saltbr-in | 3.0002 | HRD-in | -87.47, -56.42 | 74.36, 10.84 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0458 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -146.15, 132.37 | APE9-dihe-na | 88.39, 126.79 | APE8-dihe-in | -50.94, 133.96 | APE8-rot-in | 297.34 | APE67-dihe-in | -61.54, -24.84 | -43.64, -49.19 | APE12-dist-in | 13.2871 | APE11-dist-in | 10.4171 | APE10-dist-in | 7.7292 | APE9-dist-in | 3.1286 | None | TPO160 | TPO160 | XRAY | 2.24 | 0.219 | 0.268 | A | 303.0 | 297.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h26 | CMGC_CDK2_HUMAN | CMGC | 6.8e-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 | 1H26C | P24941 | 1 | 297 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.338 | 15.1892 | BLAminus | -129.56, -170.99 | 38.09, 89.21 | -96.19, 16.9 | 282.78, 62.93 | -51.84, -27.15 | in-in | in | 8.5231 | Saltbr-in | 2.6433 | HRD-in | -83.53, -52.88 | 73.72, 5.54 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9536 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.19, 136.75 | APE9-dihe-na | 80.79, 120.39 | APE8-dihe-in | -42.38, 138.45 | APE8-rot-in | 303.56 | APE67-dihe-in | -41.05, -33.69 | -41.82, -70.9 | APE12-dist-in | 12.9852 | APE11-dist-in | 10.0154 | APE10-dist-in | 7.0581 | APE9-dist-in | 3.2679 | None | TPO160 | TPO160 | XRAY | 2.24 | 0.219 | 0.268 | C | 303.0 | 268.0 | 29 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h26 | CMGC_CDK2_HUMAN | CMGC | 6.8e-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 | 1H26A | P24941 | 1 | 297 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.7068 | 15.2308 | BLAminus | -130.74, 179.93 | 49.99, 80.78 | -90.99, 22.63 | 278.59, 67.54 | -55.88, -33.36 | in-in | in | 8.5127 | Saltbr-in | 3.0002 | HRD-in | -87.47, -56.42 | 74.36, 10.84 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0458 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -146.15, 132.37 | APE9-dihe-na | 88.39, 126.79 | APE8-dihe-in | -50.94, 133.96 | APE8-rot-in | 297.34 | APE67-dihe-in | -61.54, -24.84 | -43.64, -49.19 | APE12-dist-in | 13.2871 | APE11-dist-in | 10.4171 | APE10-dist-in | 7.7292 | APE9-dist-in | 3.1286 | None | TPO160 | TPO160 | XRAY | 2.24 | 0.219 | 0.268 | A | 303.0 | 297.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h26 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.8e-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 | 1H26C | P24941 | 1 | 297 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.338 | 15.1892 | BLAminus | -129.56, -170.99 | 38.09, 89.21 | -96.19, 16.9 | 282.78, 62.93 | -51.84, -27.15 | in-in | in | 8.5231 | Saltbr-in | 2.6433 | HRD-in | -83.53, -52.88 | 73.72, 5.54 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9536 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.19, 136.75 | APE9-dihe-na | 80.79, 120.39 | APE8-dihe-in | -42.38, 138.45 | APE8-rot-in | 303.56 | APE67-dihe-in | -41.05, -33.69 | -41.82, -70.9 | APE12-dist-in | 12.9852 | APE11-dist-in | 10.0154 | APE10-dist-in | 7.0581 | APE9-dist-in | 3.2679 | None | TPO160 | TPO160 | XRAY | 2.24 | 0.219 | 0.268 | C | 303.0 | 268.0 | 29 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h26 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.8e-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 |
|---|