| 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 | 1P5EA | P24941 | 1 | 296 | 298.0 | TBS:60301 | Type1 | Active | DFGin | 6.6601 | 15.0087 | BLAminus | -134.09, 174.42 | 61.34, 86.25 | -103.57, 17.59 | 277.72, 74.26 | -59.56, -33.53 | in-in | in | 8.446 | Saltbr-in | 2.6737 | HRD-in | -77.23, -55.8 | 76.04, 12.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9986 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -75.42, 162.63 | APE9-dihe-na | 83.55, 127.96 | APE8-dihe-in | -48.61, 129.88 | APE8-rot-in | 295.62 | APE67-dihe-in | -60.38, -24.79 | -44.17, -46.98 | APE12-dist-in | 13.3074 | APE11-dist-in | 12.3142 | APE10-dist-in | 7.4388 | APE9-dist-in | 3.1856 | None | TPO160 | TPO160 | XRAY | 2.22 | 0.229 | 0.257 | A | 299.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1p5e | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 | 1P5EC | P24941 | 1 | 296 | 298.0 | TBS:60302 | Type1 | Active | DFGin | 6.6358 | 15.1272 | BLAminus | -138.76, 179.25 | 54.43, 79.27 | -94.7, 19.86 | 280.45, 76.08 | -62.71, -27.5 | in-in | in | 8.5824 | Saltbr-in | 2.7289 | HRD-in | -86.27, -53.86 | 71.16, 5.43 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.91 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -73.64, 170.31 | APE9-dihe-na | 70.48, 126.73 | APE8-dihe-in | -48.62, 130.16 | APE8-rot-in | 290.02 | APE67-dihe-in | -53.04, -25.69 | -34.83, -58.58 | APE12-dist-in | 13.2746 | APE11-dist-in | 12.4662 | APE10-dist-in | 7.4373 | APE9-dist-in | 3.2041 | None | TPO160 | TPO160 | XRAY | 2.22 | 0.229 | 0.257 | C | 299.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1p5e | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 | 1P5EA | P24941 | 1 | 296 | 298.0 | TBS:60301 | Type1 | Active | DFGin | 6.6601 | 15.0087 | BLAminus | -134.09, 174.42 | 61.34, 86.25 | -103.57, 17.59 | 277.72, 74.26 | -59.56, -33.53 | in-in | in | 8.446 | Saltbr-in | 2.6737 | HRD-in | -77.23, -55.8 | 76.04, 12.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9986 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -75.42, 162.63 | APE9-dihe-na | 83.55, 127.96 | APE8-dihe-in | -48.61, 129.88 | APE8-rot-in | 295.62 | APE67-dihe-in | -60.38, -24.79 | -44.17, -46.98 | APE12-dist-in | 13.3074 | APE11-dist-in | 12.3142 | APE10-dist-in | 7.4388 | APE9-dist-in | 3.1856 | None | TPO160 | TPO160 | XRAY | 2.22 | 0.229 | 0.257 | A | 299.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1p5e | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 | 1P5EC | P24941 | 1 | 296 | 298.0 | TBS:60302 | Type1 | Active | DFGin | 6.6358 | 15.1272 | BLAminus | -138.76, 179.25 | 54.43, 79.27 | -94.7, 19.86 | 280.45, 76.08 | -62.71, -27.5 | in-in | in | 8.5824 | Saltbr-in | 2.7289 | HRD-in | -86.27, -53.86 | 71.16, 5.43 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.91 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -73.64, 170.31 | APE9-dihe-na | 70.48, 126.73 | APE8-dihe-in | -48.62, 130.16 | APE8-rot-in | 290.02 | APE67-dihe-in | -53.04, -25.69 | -34.83, -58.58 | APE12-dist-in | 13.2746 | APE11-dist-in | 12.4662 | APE10-dist-in | 7.4373 | APE9-dist-in | 3.2041 | None | TPO160 | TPO160 | XRAY | 2.22 | 0.229 | 0.257 | C | 299.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1p5e | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 |
|---|