| 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 | 2WMAA | P24941 | 1 | 296 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.568 | 15.0493 | BLAminus | -133.6, 177.0 | 58.82, 73.66 | -85.95, 28.46 | 282.46, 64.37 | -59.09, -39.37 | in-in | in | 8.1676 | Saltbr-in | 2.6675 | HRD-in | -79.36, -47.13 | 63.08, 19.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0043 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.91, 131.32 | APE9-dihe-na | 75.18, 124.55 | APE8-dihe-in | -49.63, 128.6 | APE8-rot-in | 283.16 | APE67-dihe-in | -57.29, -20.52 | -38.45, -49.54 | APE12-dist-in | 12.7468 | APE11-dist-in | 10.1556 | APE10-dist-in | 7.6717 | APE9-dist-in | 3.2249 | None | TPO160 | TPO160 | XRAY | 2.8 | 0.215 | 0.285 | A | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wma | 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 | 2WMAC | P24941 | 1 | 296 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.3841 | 15.1203 | BLAminus | -145.3, 179.74 | 48.13, 83.21 | -99.37, 24.44 | 286.5, 69.16 | -57.18, -31.45 | in-in | in | 8.5186 | Saltbr-in | 2.7948 | HRD-in | -78.02, -42.4 | 57.96, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7533 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.94, 135.9 | APE9-dihe-na | 64.4, 130.25 | APE8-dihe-in | -51.81, 136.9 | APE8-rot-in | 318.83 | APE67-dihe-in | -40.81, -43.76 | -29.69, -71.87 | APE12-dist-in | 12.7023 | APE11-dist-in | 9.7687 | APE10-dist-in | 7.2867 | APE9-dist-in | 3.3118 | None | TPO160 | TPO160 | XRAY | 2.8 | 0.215 | 0.285 | C | 303.0 | 265.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wma | 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 | 2WMAA | P24941 | 1 | 296 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.568 | 15.0493 | BLAminus | -133.6, 177.0 | 58.82, 73.66 | -85.95, 28.46 | 282.46, 64.37 | -59.09, -39.37 | in-in | in | 8.1676 | Saltbr-in | 2.6675 | HRD-in | -79.36, -47.13 | 63.08, 19.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0043 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.91, 131.32 | APE9-dihe-na | 75.18, 124.55 | APE8-dihe-in | -49.63, 128.6 | APE8-rot-in | 283.16 | APE67-dihe-in | -57.29, -20.52 | -38.45, -49.54 | APE12-dist-in | 12.7468 | APE11-dist-in | 10.1556 | APE10-dist-in | 7.6717 | APE9-dist-in | 3.2249 | None | TPO160 | TPO160 | XRAY | 2.8 | 0.215 | 0.285 | A | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wma | 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 | 2WMAC | P24941 | 1 | 296 | 298.0 | No_ligand | No_ligand | Active | DFGin | 6.3841 | 15.1203 | BLAminus | -145.3, 179.74 | 48.13, 83.21 | -99.37, 24.44 | 286.5, 69.16 | -57.18, -31.45 | in-in | in | 8.5186 | Saltbr-in | 2.7948 | HRD-in | -78.02, -42.4 | 57.96, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7533 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.94, 135.9 | APE9-dihe-na | 64.4, 130.25 | APE8-dihe-in | -51.81, 136.9 | APE8-rot-in | 318.83 | APE67-dihe-in | -40.81, -43.76 | -29.69, -71.87 | APE12-dist-in | 12.7023 | APE11-dist-in | 9.7687 | APE10-dist-in | 7.2867 | APE9-dist-in | 3.3118 | None | TPO160 | TPO160 | XRAY | 2.8 | 0.215 | 0.285 | C | 303.0 | 265.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wma | 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 |
|---|