| 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 | 2UUEA | P24941 | 1 | 296 | 298.0 | MTZ:1297 | Type1 | Inactive | DFGin | 6.668 | 15.552 | BLAminus | -136.51, -179.65 | 55.04, 76.1 | -99.46, 27.06 | 276.81, 66.03 | -71.99, -20.9 | in-in | in | 8.424 | Saltbr-in | 2.99 | HRD-in | -83.38, -47.65 | 80.14, -16.01 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.883 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oioi | APE10-dihe-na | -101.45, 44.37 | APE9-dihe-na | -136.17, 15.14 | APE8-dihe-out | 83.13, 148.34 | APE8-rot-out | 226.35 | APE67-dihe-in | -65.4, -22.8 | -105.43, -48.8 | APE12-dist-out | 14.683 | APE11-dist-in | 11.62 | APE10-dist-out | 9.277 | APE9-dist-in | 5.446 | None | None | None | XRAY | 2.06 | 0.197 | 0.244 | A | 298 | 296 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2uue | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK2 | CDK2_HUMAN | 2UUEC | P24941 | 1 | 297 | 298.0 | MTZ:1298 | Type1 | Inactive | DFGin | 6.549 | 15.634 | BLAminus | -139.6, 174.69 | 63.14, 72.39 | -91.13, 24.55 | 277.59, 65.12 | -71.23, -27.72 | in-in | in | 8.585 | Saltbr-in | 2.887 | HRD-in | -84.99, -51.24 | 81.34, -14.94 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.846 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oioi | APE10-dihe-na | -103.79, 100.15 | APE9-dihe-na | -148.09, 37.68 | APE8-dihe-out | 71.12, 132.14 | APE8-rot-in | 268.33 | APE67-dihe-in | -63.15, -29.14 | -103.73, -38.08 | APE12-dist-out | 14.954 | APE11-dist-in | 10.215 | APE10-dist-out | 10.31 | APE9-dist-in | 5.642 | None | None | None | XRAY | 2.06 | 0.197 | 0.244 | C | 298 | 297 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2uue | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 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 | 2UUEA | P24941 | 1 | 296 | 298.0 | MTZ:1297 | Type1 | Inactive | DFGin | 6.668 | 15.552 | BLAminus | -136.51, -179.65 | 55.04, 76.1 | -99.46, 27.06 | 276.81, 66.03 | -71.99, -20.9 | in-in | in | 8.424 | Saltbr-in | 2.99 | HRD-in | -83.38, -47.65 | 80.14, -16.01 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.883 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oioi | APE10-dihe-na | -101.45, 44.37 | APE9-dihe-na | -136.17, 15.14 | APE8-dihe-out | 83.13, 148.34 | APE8-rot-out | 226.35 | APE67-dihe-in | -65.4, -22.8 | -105.43, -48.8 | APE12-dist-out | 14.683 | APE11-dist-in | 11.62 | APE10-dist-out | 9.277 | APE9-dist-in | 5.446 | None | None | None | XRAY | 2.06 | 0.197 | 0.244 | A | 298 | 296 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2uue | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 185 | 172 | 167 | 166 | 165 | 164 | 163 | 162 | 161 | 81 | Cyclin-dependent kinase 2 |
| CMGC | CDK2 | CDK2_HUMAN | 2UUEC | P24941 | 1 | 297 | 298.0 | MTZ:1298 | Type1 | Inactive | DFGin | 6.549 | 15.634 | BLAminus | -139.6, 174.69 | 63.14, 72.39 | -91.13, 24.55 | 277.59, 65.12 | -71.23, -27.72 | in-in | in | 8.585 | Saltbr-in | 2.887 | HRD-in | -84.99, -51.24 | 81.34, -14.94 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.846 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oioi | APE10-dihe-na | -103.79, 100.15 | APE9-dihe-na | -148.09, 37.68 | APE8-dihe-out | 71.12, 132.14 | APE8-rot-in | 268.33 | APE67-dihe-in | -63.15, -29.14 | -103.73, -38.08 | APE12-dist-out | 14.954 | APE11-dist-in | 10.215 | APE10-dist-out | 10.31 | APE9-dist-in | 5.642 | None | None | None | XRAY | 2.06 | 0.197 | 0.244 | C | 298 | 297 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2uue | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 1 | 301 | 301 | 144 | 145 | 146 | 148 | 150 | 33 | 51 | 55 | 124 | 126 | 125 | 127 | 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 |
|---|