| 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 | 4EOQA | P24941 | 1 | 297 | 298.0 | ATP:60301 | ATPlike | Inactive | DFGin | 6.6029 | 15.2578 | BLAminus | -136.2, -179.04 | 55.17, 77.3 | -91.43, 19.33 | 282.26, 72.55 | -64.29, -18.87 | in-in | in | 8.7855 | Saltbr-in | 2.8451 | HRD-in | -79.78, -53.17 | 69.74, 9.41 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9063 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | 62.26, 128.16 | APE9-dihe-na | 76.05, 127.33 | APE8-dihe-in | -62.55, 137.94 | APE8-rot-out | 115.71 | APE67-dihe-in | -58.94, -23.33 | -43.56, -48.15 | APE12-dist-in | 13.3614 | APE11-dist-in | 9.1579 | APE10-dist-in | 7.1767 | APE9-dist-in | 3.2463 | None | TPO160 | TPO160 | XRAY | 2.15 | 0.201 | 0.234 | A | 301.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eoq | 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 | 4EOQC | P24941 | 1 | 296 | 298.0 | ATP:60301 | ATPlike | Inactive | DFGin | 6.5834 | 15.2493 | BLAminus | -140.92, -177.14 | 51.0, 72.99 | -85.26, 24.65 | 284.32, 71.69 | -63.95, -27.55 | in-in | in | 8.6489 | Saltbr-in | 2.7133 | HRD-in | -79.85, -57.3 | 73.26, 6.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9487 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.95, 149.43 | APE9-dihe-na | 70.01, 126.65 | APE8-dihe-in | -62.68, 144.35 | APE8-rot-out | 86.91 | APE67-dihe-in | -60.3, -23.97 | -41.77, -51.35 | APE12-dist-in | 12.9226 | APE11-dist-in | 9.9884 | APE10-dist-in | 7.0552 | APE9-dist-in | 3.1801 | None | TPO160 | TPO160 | XRAY | 2.15 | 0.201 | 0.234 | C | 301.0 | 272.0 | 24 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eoq | 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 | 4EOQA | P24941 | 1 | 297 | 298.0 | ATP:60301 | ATPlike | Inactive | DFGin | 6.6029 | 15.2578 | BLAminus | -136.2, -179.04 | 55.17, 77.3 | -91.43, 19.33 | 282.26, 72.55 | -64.29, -18.87 | in-in | in | 8.7855 | Saltbr-in | 2.8451 | HRD-in | -79.78, -53.17 | 69.74, 9.41 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9063 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | 62.26, 128.16 | APE9-dihe-na | 76.05, 127.33 | APE8-dihe-in | -62.55, 137.94 | APE8-rot-out | 115.71 | APE67-dihe-in | -58.94, -23.33 | -43.56, -48.15 | APE12-dist-in | 13.3614 | APE11-dist-in | 9.1579 | APE10-dist-in | 7.1767 | APE9-dist-in | 3.2463 | None | TPO160 | TPO160 | XRAY | 2.15 | 0.201 | 0.234 | A | 301.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eoq | 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 | 4EOQC | P24941 | 1 | 296 | 298.0 | ATP:60301 | ATPlike | Inactive | DFGin | 6.5834 | 15.2493 | BLAminus | -140.92, -177.14 | 51.0, 72.99 | -85.26, 24.65 | 284.32, 71.69 | -63.95, -27.55 | in-in | in | 8.6489 | Saltbr-in | 2.7133 | HRD-in | -79.85, -57.3 | 73.26, 6.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9487 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.95, 149.43 | APE9-dihe-na | 70.01, 126.65 | APE8-dihe-in | -62.68, 144.35 | APE8-rot-out | 86.91 | APE67-dihe-in | -60.3, -23.97 | -41.77, -51.35 | APE12-dist-in | 12.9226 | APE11-dist-in | 9.9884 | APE10-dist-in | 7.0552 | APE9-dist-in | 3.1801 | None | TPO160 | TPO160 | XRAY | 2.15 | 0.201 | 0.234 | C | 301.0 | 272.0 | 24 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4eoq | 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 |
|---|