| 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 | 2IW9A | P24941 | 1 | 297 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.9195 | 15.0193 | BLAminus | -131.25, 177.14 | 50.41, 78.45 | -89.19, 19.11 | 279.3, 70.96 | -63.04, -21.92 | in-in | in | 8.6273 | Saltbr-in | 2.6639 | HRD-in | -76.84, -55.24 | 73.81, 13.13 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8738 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.48, 158.17 | APE9-dihe-na | 69.51, 127.63 | APE8-dihe-in | -55.41, 136.69 | APE8-rot-in | 292.83 | APE67-dihe-in | -55.29, -27.14 | -47.71, -50.1 | APE12-dist-in | 13.1033 | APE11-dist-in | 10.3046 | APE10-dist-in | 7.1543 | APE9-dist-in | 3.2322 | K89T | TPO160 | TPO160 | XRAY | 2.0 | 0.212 | 0.24 | A | 302.0 | 293.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2iw9 | CMGC_CDK2_HUMAN | CMGC | 1.8e-89 | 306.4 | 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 | 2IW9C | P24941 | 1 | 296 | 298.0 | 4SP:61297 | Type1 | Active | DFGin | 6.806 | 14.9605 | BLAminus | -133.02, -178.76 | 46.09, 77.69 | -88.26, 25.13 | 279.73, 69.06 | -66.3, -29.69 | in-in | in | 8.5024 | Saltbr-in | 2.5435 | HRD-in | -78.99, -52.42 | 69.26, 9.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9662 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.41, 143.8 | APE9-dihe-na | 66.28, 132.13 | APE8-dihe-in | -59.08, 144.46 | APE8-rot-in | 305.7 | APE67-dihe-in | -55.93, -27.46 | -43.85, -53.77 | APE12-dist-in | 12.8797 | APE11-dist-in | 9.9315 | APE10-dist-in | 7.2757 | APE9-dist-in | 3.1998 | K89T | TPO160 | TPO160 | XRAY | 2.0 | 0.212 | 0.24 | C | 302.0 | 268.0 | 28 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2iw9 | CMGC_CDK2_HUMAN | CMGC | 1.8e-89 | 306.4 | 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 | 2IW9A | P24941 | 1 | 297 | 298.0 | 4SP:61298 | Type1 | Active | DFGin | 6.9195 | 15.0193 | BLAminus | -131.25, 177.14 | 50.41, 78.45 | -89.19, 19.11 | 279.3, 70.96 | -63.04, -21.92 | in-in | in | 8.6273 | Saltbr-in | 2.6639 | HRD-in | -76.84, -55.24 | 73.81, 13.13 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8738 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.48, 158.17 | APE9-dihe-na | 69.51, 127.63 | APE8-dihe-in | -55.41, 136.69 | APE8-rot-in | 292.83 | APE67-dihe-in | -55.29, -27.14 | -47.71, -50.1 | APE12-dist-in | 13.1033 | APE11-dist-in | 10.3046 | APE10-dist-in | 7.1543 | APE9-dist-in | 3.2322 | K89T | TPO160 | TPO160 | XRAY | 2.0 | 0.212 | 0.24 | A | 302.0 | 293.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2iw9 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 1.8e-89 | 306.4 | 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 | 2IW9C | P24941 | 1 | 296 | 298.0 | 4SP:61297 | Type1 | Active | DFGin | 6.806 | 14.9605 | BLAminus | -133.02, -178.76 | 46.09, 77.69 | -88.26, 25.13 | 279.73, 69.06 | -66.3, -29.69 | in-in | in | 8.5024 | Saltbr-in | 2.5435 | HRD-in | -78.99, -52.42 | 69.26, 9.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9662 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.41, 143.8 | APE9-dihe-na | 66.28, 132.13 | APE8-dihe-in | -59.08, 144.46 | APE8-rot-in | 305.7 | APE67-dihe-in | -55.93, -27.46 | -43.85, -53.77 | APE12-dist-in | 12.8797 | APE11-dist-in | 9.9315 | APE10-dist-in | 7.2757 | APE9-dist-in | 3.1998 | K89T | TPO160 | TPO160 | XRAY | 2.0 | 0.212 | 0.24 | C | 302.0 | 268.0 | 28 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2iw9 | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 1.8e-89 | 306.4 | 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 |
|---|