| 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 | 3DDQA | P24941 | 1 | 298 | 298.0 | RRC:60299 | Type1 | Active | DFGin | 6.8795 | 15.378 | BLAminus | -132.75, 169.79 | 57.41, 82.03 | -94.85, 22.97 | 280.61, 68.74 | -62.61, -27.68 | in-in | in | 8.7174 | Saltbr-in | 2.6315 | HRD-in | -76.69, -57.1 | 75.95, 10.79 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8915 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | 66.92, 123.95 | APE9-dihe-na | 76.33, 127.94 | APE8-dihe-in | -56.03, 136.54 | APE8-rot-in | 295.57 | APE67-dihe-in | -61.4, -22.16 | -47.57, -46.39 | APE12-dist-in | 13.2992 | APE11-dist-in | 9.21 | APE10-dist-in | 7.3861 | APE9-dist-in | 3.2138 | None | TPO160 | TPO160 | XRAY | 1.8 | 0.196 | 0.229 | A | 299.0 | 296.0 | 2 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3ddq | 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 | 3DDQC | P24941 | 1 | 297 | 298.0 | RRC:60299 | Type1 | Inactive | DFGin | 6.6826 | 15.2371 | BLAminus | -135.03, 174.73 | 51.22, 81.22 | -92.28, 22.06 | 280.24, 71.12 | -61.17, -31.8 | in-in | in | 8.8023 | Saltbr-in | 2.6292 | HRD-in | -78.79, -55.27 | 70.81, 11.54 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9141 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -133.5, 150.72 | APE9-dihe-na | 67.57, 123.07 | APE8-dihe-in | -58.23, 146.27 | APE8-rot-out | 184.04 | APE67-dihe-in | -63.49, -21.74 | -43.48, -49.11 | APE12-dist-in | 12.7649 | APE11-dist-in | 9.9876 | APE10-dist-in | 6.8634 | APE9-dist-in | 3.2438 | None | TPO160 | TPO160 | XRAY | 1.8 | 0.196 | 0.229 | C | 299.0 | 266.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3ddq | 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 | 3DDQA | P24941 | 1 | 298 | 298.0 | RRC:60299 | Type1 | Active | DFGin | 6.8795 | 15.378 | BLAminus | -132.75, 169.79 | 57.41, 82.03 | -94.85, 22.97 | 280.61, 68.74 | -62.61, -27.68 | in-in | in | 8.7174 | Saltbr-in | 2.6315 | HRD-in | -76.69, -57.1 | 75.95, 10.79 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8915 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | 66.92, 123.95 | APE9-dihe-na | 76.33, 127.94 | APE8-dihe-in | -56.03, 136.54 | APE8-rot-in | 295.57 | APE67-dihe-in | -61.4, -22.16 | -47.57, -46.39 | APE12-dist-in | 13.2992 | APE11-dist-in | 9.21 | APE10-dist-in | 7.3861 | APE9-dist-in | 3.2138 | None | TPO160 | TPO160 | XRAY | 1.8 | 0.196 | 0.229 | A | 299.0 | 296.0 | 2 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3ddq | 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 | 3DDQC | P24941 | 1 | 297 | 298.0 | RRC:60299 | Type1 | Inactive | DFGin | 6.6826 | 15.2371 | BLAminus | -135.03, 174.73 | 51.22, 81.22 | -92.28, 22.06 | 280.24, 71.12 | -61.17, -31.8 | in-in | in | 8.8023 | Saltbr-in | 2.6292 | HRD-in | -78.79, -55.27 | 70.81, 11.54 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9141 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -133.5, 150.72 | APE9-dihe-na | 67.57, 123.07 | APE8-dihe-in | -58.23, 146.27 | APE8-rot-out | 184.04 | APE67-dihe-in | -63.49, -21.74 | -43.48, -49.11 | APE12-dist-in | 12.7649 | APE11-dist-in | 9.9876 | APE10-dist-in | 6.8634 | APE9-dist-in | 3.2438 | None | TPO160 | TPO160 | XRAY | 1.8 | 0.196 | 0.229 | C | 299.0 | 266.0 | 31 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3ddq | 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 |
|---|