| 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 | 3F5XA | P24941 | 1 | 298 | 298.0 | EZV:300 | Type1.5_Back | Inactive | DFGin | 6.264 | 15.1438 | BLAminus | -134.58, -179.48 | 51.7, 79.18 | -97.87, 23.07 | 283.96, 70.29 | -60.84, -38.34 | in-in | in | 8.6882 | Saltbr-in | 2.691 | HRD-in | -75.24, -51.59 | 71.39, 2.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8085 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioi | APE10-dihe-na | -175.83, 160.35 | APE9-dihe-na | 3.68, 102.57 | APE8-dihe-in | -38.96, 146.61 | APE8-rot-out | 193.19 | APE67-dihe-in | -61.73, -24.77 | -51.83, -42.77 | APE12-dist-in | 11.5028 | APE11-dist-in | 8.374 | APE10-dist-out | 8.4333 | APE9-dist-in | 4.0064 | None | None | None | XRAY | 2.4 | 0.266 | 0.283 | A | 298.0 | 297.0 | 1 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3f5x | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 3F5XC | P24941 | 1 | 298 | 298.0 | EZV:300 | Type1.5_Back | Inactive | DFGin | 6.4071 | 15.4598 | BLAminus | -135.18, 179.33 | 51.86, 80.85 | -99.79, 26.02 | 279.88, 72.23 | -63.21, -36.5 | in-in | in | 8.8073 | Saltbr-in | 3.0658 | HRD-in | -71.85, -53.32 | 74.6, -0.68 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8196 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | 133.52, -152.44 | APE9-dihe-na | 7.07, 96.3 | APE8-dihe-in | -36.48, 145.34 | APE8-rot-out | 171.35 | APE67-dihe-in | -62.68, -23.78 | -54.39, -38.57 | APE12-dist-in | 11.4919 | APE11-dist-in | 8.7993 | APE10-dist-in | 6.6792 | APE9-dist-in | 3.9337 | None | None | None | XRAY | 2.4 | 0.266 | 0.283 | C | 298.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3f5x | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 3F5XA | P24941 | 1 | 298 | 298.0 | EZV:300 | Type1.5_Back | Inactive | DFGin | 6.264 | 15.1438 | BLAminus | -134.58, -179.48 | 51.7, 79.18 | -97.87, 23.07 | 283.96, 70.29 | -60.84, -38.34 | in-in | in | 8.6882 | Saltbr-in | 2.691 | HRD-in | -75.24, -51.59 | 71.39, 2.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8085 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioi | APE10-dihe-na | -175.83, 160.35 | APE9-dihe-na | 3.68, 102.57 | APE8-dihe-in | -38.96, 146.61 | APE8-rot-out | 193.19 | APE67-dihe-in | -61.73, -24.77 | -51.83, -42.77 | APE12-dist-in | 11.5028 | APE11-dist-in | 8.374 | APE10-dist-out | 8.4333 | APE9-dist-in | 4.0064 | None | None | None | XRAY | 2.4 | 0.266 | 0.283 | A | 298.0 | 297.0 | 1 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3f5x | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 3F5XC | P24941 | 1 | 298 | 298.0 | EZV:300 | Type1.5_Back | Inactive | DFGin | 6.4071 | 15.4598 | BLAminus | -135.18, 179.33 | 51.86, 80.85 | -99.79, 26.02 | 279.88, 72.23 | -63.21, -36.5 | in-in | in | 8.8073 | Saltbr-in | 3.0658 | HRD-in | -71.85, -53.32 | 74.6, -0.68 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8196 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | 133.52, -152.44 | APE9-dihe-na | 7.07, 96.3 | APE8-dihe-in | -36.48, 145.34 | APE8-rot-out | 171.35 | APE67-dihe-in | -62.68, -23.78 | -54.39, -38.57 | APE12-dist-in | 11.4919 | APE11-dist-in | 8.7993 | APE10-dist-in | 6.6792 | APE9-dist-in | 3.9337 | None | None | None | XRAY | 2.4 | 0.266 | 0.283 | C | 298.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3f5x | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 |
|---|