| 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 | 6GUCA | P24941 | 1 | 296 | 298.0 | SU9:60301 | Type1 | Active | DFGin | 6.973 | 15.27 | BLAminus | -136.48, 168.46 | 59.83, 87.4 | -95.55, 17.68 | 283.77, 73.7 | -70.07, -21.28 | in-in | in | 8.605 | Saltbr-in | 2.995 | HRD-in | -78.14, -56.76 | 74.58, 14.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.077 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -101.08, 164.22 | APE9-dihe-na | 82.25, 131.29 | APE8-dihe-in | -49.82, 131.18 | APE8-rot-in | 295.31 | APE67-dihe-in | -63.1, -17.25 | -48.27, -47.54 | APE12-dist-in | 13.479 | APE11-dist-in | 12.482 | APE10-dist-in | 7.719 | APE9-dist-in | 3.315 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.193 | 0.223 | A | 302 | 291 | 5 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 6guc | CMGC_CDK2_HUMAN | CMGC | 6.7e-90 | 307.8 | 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 | 6GUCC | P24941 | 1 | 296 | 298.0 | SU9:60301 | Type1 | Active | DFGin | 6.908 | 15.265 | BLAminus | -133.88, 171.8 | 59.27, 85.55 | -96.14, 18.38 | 283.75, 72.67 | -65.8, -24.99 | in-in | in | 8.617 | Saltbr-in | 2.943 | HRD-in | -77.5, -55.72 | 68.85, 17.91 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.077 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.23, 146.05 | APE9-dihe-na | 73.9, 127.31 | APE8-dihe-in | -45.15, 131.88 | APE8-rot-in | 300.07 | APE67-dihe-in | -61.56, -19.13 | -46.74, -49.91 | APE12-dist-in | 13.139 | APE11-dist-in | 10.3 | APE10-dist-in | 7.209 | APE9-dist-in | 3.388 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.193 | 0.223 | C | 302 | 296 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 6guc | CMGC_CDK2_HUMAN | CMGC | 6.7e-90 | 307.8 | 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 | 6GUCA | P24941 | 1 | 296 | 298.0 | SU9:60301 | Type1 | Active | DFGin | 6.973 | 15.27 | BLAminus | -136.48, 168.46 | 59.83, 87.4 | -95.55, 17.68 | 283.77, 73.7 | -70.07, -21.28 | in-in | in | 8.605 | Saltbr-in | 2.995 | HRD-in | -78.14, -56.76 | 74.58, 14.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.077 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -101.08, 164.22 | APE9-dihe-na | 82.25, 131.29 | APE8-dihe-in | -49.82, 131.18 | APE8-rot-in | 295.31 | APE67-dihe-in | -63.1, -17.25 | -48.27, -47.54 | APE12-dist-in | 13.479 | APE11-dist-in | 12.482 | APE10-dist-in | 7.719 | APE9-dist-in | 3.315 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.193 | 0.223 | A | 302 | 291 | 5 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 6guc | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-90 | 307.8 | 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 | 6GUCC | P24941 | 1 | 296 | 298.0 | SU9:60301 | Type1 | Active | DFGin | 6.908 | 15.265 | BLAminus | -133.88, 171.8 | 59.27, 85.55 | -96.14, 18.38 | 283.75, 72.67 | -65.8, -24.99 | in-in | in | 8.617 | Saltbr-in | 2.943 | HRD-in | -77.5, -55.72 | 68.85, 17.91 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.077 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.23, 146.05 | APE9-dihe-na | 73.9, 127.31 | APE8-dihe-in | -45.15, 131.88 | APE8-rot-in | 300.07 | APE67-dihe-in | -61.56, -19.13 | -46.74, -49.91 | APE12-dist-in | 13.139 | APE11-dist-in | 10.3 | APE10-dist-in | 7.209 | APE9-dist-in | 3.388 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.193 | 0.223 | C | 302 | 296 | 0 | 0 | 0 | 0 | [[4, 286]] | 1.0 | 6guc | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-90 | 307.8 | 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 |
|---|