| 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 | 4BCMA | P24941 | 1 | 296 | 298.0 | T7Z:61297 | Type1 | Active | DFGin | 6.5188 | 15.3382 | BLAminus | -139.66, 174.2 | 58.72, 79.02 | -93.6, 24.76 | 282.71, 70.29 | -67.74, -29.26 | in-in | in | 8.8258 | Saltbr-in | 2.8021 | HRD-in | -76.71, -53.42 | 71.43, 16.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8555 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.32, 150.29 | APE9-dihe-na | 79.09, 129.96 | APE8-dihe-in | -55.49, 136.02 | APE8-rot-in | 301.59 | APE67-dihe-in | -59.49, -23.97 | -43.8, -51.06 | APE12-dist-in | 13.1922 | APE11-dist-in | 10.4094 | APE10-dist-in | 7.1915 | APE9-dist-in | 3.251 | None | TPO160 | TPO160 | XRAY | 2.45 | 0.198 | 0.258 | A | 301.0 | 293.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4bcm | CMGC_CDK2_HUMAN | CMGC | 6.6e-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 | 4BCMC | P24941 | 1 | 294 | 298.0 | T7Z:61295 | Type1 | Active | DFGin | 6.1946 | 15.2058 | BLAminus | -144.88, 174.61 | 58.31, 79.88 | -94.05, 24.48 | 286.22, 64.67 | -52.96, -36.75 | in-in | in | 8.9292 | Saltbr-in | 2.868 | HRD-in | -78.72, -52.42 | 66.78, 17.05 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.834 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -144.18, 152.85 | APE9-dihe-na | 70.08, 132.37 | APE8-dihe-in | -63.98, 114.75 | APE8-rot-in | 298.59 | APE67-dihe-in | -41.3, -28.08 | -11.16, -73.96 | APE12-dist-in | 13.0788 | APE11-dist-in | 10.2273 | APE10-dist-in | 7.1356 | APE9-dist-in | 3.1813 | None | TPO160 | TPO160 | XRAY | 2.45 | 0.198 | 0.258 | C | 301.0 | 294.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4bcm | CMGC_CDK2_HUMAN | CMGC | 6.6e-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 | 4BCMA | P24941 | 1 | 296 | 298.0 | T7Z:61297 | Type1 | Active | DFGin | 6.5188 | 15.3382 | BLAminus | -139.66, 174.2 | 58.72, 79.02 | -93.6, 24.76 | 282.71, 70.29 | -67.74, -29.26 | in-in | in | 8.8258 | Saltbr-in | 2.8021 | HRD-in | -76.71, -53.42 | 71.43, 16.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8555 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.32, 150.29 | APE9-dihe-na | 79.09, 129.96 | APE8-dihe-in | -55.49, 136.02 | APE8-rot-in | 301.59 | APE67-dihe-in | -59.49, -23.97 | -43.8, -51.06 | APE12-dist-in | 13.1922 | APE11-dist-in | 10.4094 | APE10-dist-in | 7.1915 | APE9-dist-in | 3.251 | None | TPO160 | TPO160 | XRAY | 2.45 | 0.198 | 0.258 | A | 301.0 | 293.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4bcm | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.6e-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 | 4BCMC | P24941 | 1 | 294 | 298.0 | T7Z:61295 | Type1 | Active | DFGin | 6.1946 | 15.2058 | BLAminus | -144.88, 174.61 | 58.31, 79.88 | -94.05, 24.48 | 286.22, 64.67 | -52.96, -36.75 | in-in | in | 8.9292 | Saltbr-in | 2.868 | HRD-in | -78.72, -52.42 | 66.78, 17.05 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.834 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -144.18, 152.85 | APE9-dihe-na | 70.08, 132.37 | APE8-dihe-in | -63.98, 114.75 | APE8-rot-in | 298.59 | APE67-dihe-in | -41.3, -28.08 | -11.16, -73.96 | APE12-dist-in | 13.0788 | APE11-dist-in | 10.2273 | APE10-dist-in | 7.1356 | APE9-dist-in | 3.1813 | None | TPO160 | TPO160 | XRAY | 2.45 | 0.198 | 0.258 | C | 301.0 | 294.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4bcm | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.6e-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 |
|---|