| 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 | 1H1SA | P24941 | 1 | 296 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.7712 | 14.8796 | BLAminus | -138.27, 176.48 | 54.47, 75.94 | -86.39, 16.38 | 279.91, 75.66 | -60.96, -21.57 | in-in | in | 8.5233 | Saltbr-in | 2.5464 | HRD-in | -82.14, -48.27 | 62.29, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8826 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.1, 148.9 | APE9-dihe-na | 77.73, 132.64 | APE8-dihe-in | -56.46, 146.46 | APE8-rot-in | 297.88 | APE67-dihe-in | -62.68, -22.66 | -55.95, -45.74 | APE12-dist-in | 13.0409 | APE11-dist-in | 10.2524 | APE10-dist-in | 7.4877 | APE9-dist-in | 3.2162 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.236 | 0.286 | A | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h1s | 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 | 1H1SC | P24941 | 1 | 296 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.5742 | 15.0653 | BLAminus | -139.76, -179.38 | 46.77, 76.48 | -88.51, 14.99 | 275.39, 74.13 | -49.48, -23.18 | in-in | in | 8.9095 | Saltbr-in | 2.6343 | HRD-in | -75.61, -51.23 | 64.22, 19.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9302 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.84, 146.42 | APE9-dihe-na | 78.4, 136.91 | APE8-dihe-in | -69.97, 138.51 | APE8-rot-in | 287.12 | APE67-dihe-in | -55.51, -31.94 | -44.12, -51.67 | APE12-dist-in | 13.0782 | APE11-dist-in | 10.3066 | APE10-dist-in | 7.3312 | APE9-dist-in | 3.1764 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.236 | 0.286 | C | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h1s | 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 | 1H1SA | P24941 | 1 | 296 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.7712 | 14.8796 | BLAminus | -138.27, 176.48 | 54.47, 75.94 | -86.39, 16.38 | 279.91, 75.66 | -60.96, -21.57 | in-in | in | 8.5233 | Saltbr-in | 2.5464 | HRD-in | -82.14, -48.27 | 62.29, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8826 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.1, 148.9 | APE9-dihe-na | 77.73, 132.64 | APE8-dihe-in | -56.46, 146.46 | APE8-rot-in | 297.88 | APE67-dihe-in | -62.68, -22.66 | -55.95, -45.74 | APE12-dist-in | 13.0409 | APE11-dist-in | 10.2524 | APE10-dist-in | 7.4877 | APE9-dist-in | 3.2162 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.236 | 0.286 | A | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h1s | 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 | 1H1SC | P24941 | 1 | 296 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.5742 | 15.0653 | BLAminus | -139.76, -179.38 | 46.77, 76.48 | -88.51, 14.99 | 275.39, 74.13 | -49.48, -23.18 | in-in | in | 8.9095 | Saltbr-in | 2.6343 | HRD-in | -75.61, -51.23 | 64.22, 19.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9302 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.84, 146.42 | APE9-dihe-na | 78.4, 136.91 | APE8-dihe-in | -69.97, 138.51 | APE8-rot-in | 287.12 | APE67-dihe-in | -55.51, -31.94 | -44.12, -51.67 | APE12-dist-in | 13.0782 | APE11-dist-in | 10.3066 | APE10-dist-in | 7.3312 | APE9-dist-in | 3.1764 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.236 | 0.286 | C | 303.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h1s | 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 |
|---|