| 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 | 3TNWA | P24941 | 1 | 298 | 298.0 | F18:60299 | Type1 | Active | DFGin | 6.6202 | 15.0856 | BLAminus | -128.6, -178.26 | 47.86, 84.33 | -97.78, 26.02 | 281.36, 66.37 | -65.04, -21.33 | in-in | in | 8.6174 | Saltbr-in | 2.6016 | HRD-in | -79.46, -53.41 | 71.4, 11.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8879 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -136.78, 148.35 | APE9-dihe-na | 78.36, 126.94 | APE8-dihe-in | -51.14, 135.98 | APE8-rot-in | 295.07 | APE67-dihe-in | -59.03, -26.11 | -51.18, -45.17 | APE12-dist-in | 13.0257 | APE11-dist-in | 10.0124 | APE10-dist-in | 7.1954 | APE9-dist-in | 3.2048 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.188 | 0.227 | A | 300.0 | 295.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3tnw | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 3TNWC | P24941 | 1 | 294 | 298.0 | F18:60299 | Type1 | Active | DFGin | 6.3379 | 14.9648 | BLAminus | -134.92, -174.37 | 47.62, 80.87 | -94.48, 22.71 | 276.99, 67.55 | -61.56, -28.66 | in-in | in | 8.6777 | Saltbr-in | 2.9532 | HRD-in | -84.06, -55.0 | 67.89, 14.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7943 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.7, 153.65 | APE9-dihe-na | 73.74, 131.99 | APE8-dihe-in | -62.58, 141.03 | APE8-rot-in | 293.51 | APE67-dihe-in | -61.78, -24.49 | -48.04, -49.75 | APE12-dist-in | 12.9552 | APE11-dist-in | 10.0715 | APE10-dist-in | 6.9873 | APE9-dist-in | 3.2432 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.188 | 0.227 | C | 300.0 | 292.0 | 2 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3tnw | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 3TNWA | P24941 | 1 | 298 | 298.0 | F18:60299 | Type1 | Active | DFGin | 6.6202 | 15.0856 | BLAminus | -128.6, -178.26 | 47.86, 84.33 | -97.78, 26.02 | 281.36, 66.37 | -65.04, -21.33 | in-in | in | 8.6174 | Saltbr-in | 2.6016 | HRD-in | -79.46, -53.41 | 71.4, 11.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8879 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -136.78, 148.35 | APE9-dihe-na | 78.36, 126.94 | APE8-dihe-in | -51.14, 135.98 | APE8-rot-in | 295.07 | APE67-dihe-in | -59.03, -26.11 | -51.18, -45.17 | APE12-dist-in | 13.0257 | APE11-dist-in | 10.0124 | APE10-dist-in | 7.1954 | APE9-dist-in | 3.2048 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.188 | 0.227 | A | 300.0 | 295.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3tnw | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 | 3TNWC | P24941 | 1 | 294 | 298.0 | F18:60299 | Type1 | Active | DFGin | 6.3379 | 14.9648 | BLAminus | -134.92, -174.37 | 47.62, 80.87 | -94.48, 22.71 | 276.99, 67.55 | -61.56, -28.66 | in-in | in | 8.6777 | Saltbr-in | 2.9532 | HRD-in | -84.06, -55.0 | 67.89, 14.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7943 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.7, 153.65 | APE9-dihe-na | 73.74, 131.99 | APE8-dihe-in | -62.58, 141.03 | APE8-rot-in | 293.51 | APE67-dihe-in | -61.78, -24.49 | -48.04, -49.75 | APE12-dist-in | 12.9552 | APE11-dist-in | 10.0715 | APE10-dist-in | 6.9873 | APE9-dist-in | 3.2432 | None | TPO160 | TPO160 | XRAY | 2.0 | 0.188 | 0.227 | C | 300.0 | 292.0 | 2 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3tnw | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.5e-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 |
|---|