| 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 | 4EOSA | P24941 | 1 | 297 | 298.0 | 1RO:60301 | Type1 | Inactive | DFGin | 6.6789 | 14.917 | BLAminus | -141.96, 173.39 | 61.75, 76.99 | -94.88, 23.86 | 287.29, 67.82 | -62.13, -29.58 | in-in | in | 8.579 | Saltbr-in | 2.6769 | HRD-in | -71.72, -54.24 | 68.99, 15.84 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9544 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -51.01, 139.09 | APE9-dihe-na | 90.64, 134.44 | APE8-dihe-in | -63.39, 144.28 | APE8-rot-out | 31.42 | APE67-dihe-in | -59.13, -27.23 | -51.22, -47.22 | APE12-dist-in | 13.1006 | APE11-dist-in | 9.1975 | APE10-dist-in | 7.5654 | APE9-dist-in | 3.5122 | None | TPO160 | TPO160 | XRAY | 2.57 | 0.232 | 0.274 | A | 300.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eos | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 4EOSC | P24941 | 1 | 296 | 298.0 | 1RO:60301 | Type1 | Inactive | DFGin | 6.6739 | 15.293 | BLAminus | -142.14, 172.73 | 60.66, 72.59 | -88.34, 30.63 | 286.6, 69.5 | -72.66, -28.9 | in-in | in | 8.3941 | Saltbr-in | 2.6464 | HRD-in | -72.54, -50.67 | 68.34, 9.35 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9113 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.28, 156.88 | APE9-dihe-na | 66.24, 127.49 | APE8-dihe-in | -57.72, 139.89 | APE8-rot-out | 169.26 | APE67-dihe-in | -54.97, -19.05 | -46.71, -53.73 | APE12-dist-in | 13.1535 | APE11-dist-in | 10.9902 | APE10-dist-in | 7.3652 | APE9-dist-in | 3.2388 | None | TPO160 | TPO160 | XRAY | 2.57 | 0.232 | 0.274 | C | 300.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eos | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 4EOSA | P24941 | 1 | 297 | 298.0 | 1RO:60301 | Type1 | Inactive | DFGin | 6.6789 | 14.917 | BLAminus | -141.96, 173.39 | 61.75, 76.99 | -94.88, 23.86 | 287.29, 67.82 | -62.13, -29.58 | in-in | in | 8.579 | Saltbr-in | 2.6769 | HRD-in | -71.72, -54.24 | 68.99, 15.84 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9544 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -51.01, 139.09 | APE9-dihe-na | 90.64, 134.44 | APE8-dihe-in | -63.39, 144.28 | APE8-rot-out | 31.42 | APE67-dihe-in | -59.13, -27.23 | -51.22, -47.22 | APE12-dist-in | 13.1006 | APE11-dist-in | 9.1975 | APE10-dist-in | 7.5654 | APE9-dist-in | 3.5122 | None | TPO160 | TPO160 | XRAY | 2.57 | 0.232 | 0.274 | A | 300.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eos | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 4EOSC | P24941 | 1 | 296 | 298.0 | 1RO:60301 | Type1 | Inactive | DFGin | 6.6739 | 15.293 | BLAminus | -142.14, 172.73 | 60.66, 72.59 | -88.34, 30.63 | 286.6, 69.5 | -72.66, -28.9 | in-in | in | 8.3941 | Saltbr-in | 2.6464 | HRD-in | -72.54, -50.67 | 68.34, 9.35 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9113 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.28, 156.88 | APE9-dihe-na | 66.24, 127.49 | APE8-dihe-in | -57.72, 139.89 | APE8-rot-out | 169.26 | APE67-dihe-in | -54.97, -19.05 | -46.71, -53.73 | APE12-dist-in | 13.1535 | APE11-dist-in | 10.9902 | APE10-dist-in | 7.3652 | APE9-dist-in | 3.2388 | None | TPO160 | TPO160 | XRAY | 2.57 | 0.232 | 0.274 | C | 300.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eos | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 |
|---|