| 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 | 2BPMA | P24941 | 1 | 298 | 298.0 | 529:61299 | Type1 | Inactive | DFGin | 6.239 | 15.11 | BLAminus | -142.26, 176.11 | 58.91, 81.01 | -97.86, 30.66 | 284.19, 66.4 | -66.03, -17.23 | in-in | in | 8.702 | Saltbr-in | 3.207 | HRD-in | -74.89, -55.37 | 69.86, 9.24 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.876 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -145.78, 149.41 | APE9-dihe-na | -60.82, 153.33 | APE8-dihe-in | -56.05, 145.85 | APE8-rot-out | 190.64 | APE67-dihe-in | -49.62, -26.99 | -36.83, -56.93 | APE12-dist-in | 10.954 | APE11-dist-out | 6.128 | APE10-dist-out | 9.188 | APE9-dist-in | 3.97 | None | None | None | XRAY | 2.4 | 0.229 | 0.271 | A | 309 | 298 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2bpm | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2BPMC | P24941 | 1 | 298 | 298.0 | 529:61299 | Type1 | Active | DFGin | 6.476 | 15.691 | BLAminus | -139.11, -176.99 | 50.31, 82.01 | -98.98, 24.72 | 279.58, 68.95 | -62.44, -20.88 | in-in | in | 8.975 | Saltbr-in | 3.405 | HRD-in | -80.64, -57.02 | 72.88, 2.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.882 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.51, -77.27 | APE9-dihe-na | -63.86, 135.95 | APE8-dihe-in | -52.79, 132.77 | APE8-rot-in | 309.35 | APE67-dihe-in | -57.16, -24.3 | -34.82, -55.34 | APE12-dist-in | 13.242 | APE11-dist-in | 11.949 | APE10-dist-in | 7.171 | APE9-dist-in | 3.521 | None | None | None | XRAY | 2.4 | 0.229 | 0.271 | C | 309 | 298 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2bpm | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2BPMA | P24941 | 1 | 298 | 298.0 | 529:61299 | Type1 | Inactive | DFGin | 6.239 | 15.11 | BLAminus | -142.26, 176.11 | 58.91, 81.01 | -97.86, 30.66 | 284.19, 66.4 | -66.03, -17.23 | in-in | in | 8.702 | Saltbr-in | 3.207 | HRD-in | -74.89, -55.37 | 69.86, 9.24 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.876 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -145.78, 149.41 | APE9-dihe-na | -60.82, 153.33 | APE8-dihe-in | -56.05, 145.85 | APE8-rot-out | 190.64 | APE67-dihe-in | -49.62, -26.99 | -36.83, -56.93 | APE12-dist-in | 10.954 | APE11-dist-out | 6.128 | APE10-dist-out | 9.188 | APE9-dist-in | 3.97 | None | None | None | XRAY | 2.4 | 0.229 | 0.271 | A | 309 | 298 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2bpm | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2BPMC | P24941 | 1 | 298 | 298.0 | 529:61299 | Type1 | Active | DFGin | 6.476 | 15.691 | BLAminus | -139.11, -176.99 | 50.31, 82.01 | -98.98, 24.72 | 279.58, 68.95 | -62.44, -20.88 | in-in | in | 8.975 | Saltbr-in | 3.405 | HRD-in | -80.64, -57.02 | 72.88, 2.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.882 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.51, -77.27 | APE9-dihe-na | -63.86, 135.95 | APE8-dihe-in | -52.79, 132.77 | APE8-rot-in | 309.35 | APE67-dihe-in | -57.16, -24.3 | -34.82, -55.34 | APE12-dist-in | 13.242 | APE11-dist-in | 11.949 | APE10-dist-in | 7.171 | APE9-dist-in | 3.521 | None | None | None | XRAY | 2.4 | 0.229 | 0.271 | C | 309 | 298 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 2bpm | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 |
|---|