| 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 | 3MY5A | P24941 | 1 | 298 | 298.0 | RFZ:60300 | Type1 | Active | DFGin | 6.667 | 15.3481 | BLAminus | -135.55, -178.04 | 53.6, 76.52 | -97.01, 15.67 | 276.61, 75.78 | -59.51, -26.48 | in-in | in | 8.74 | Saltbr-in | 2.7654 | HRD-in | -79.62, -51.44 | 67.18, 13.09 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8831 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.67, 153.77 | APE9-dihe-na | 76.12, 127.46 | APE8-dihe-in | -56.8, 137.09 | APE8-rot-in | 303.01 | APE67-dihe-in | -62.09, -25.12 | -50.14, -44.68 | APE12-dist-in | 13.1416 | APE11-dist-in | 10.346 | APE10-dist-in | 7.1077 | APE9-dist-in | 3.2426 | None | TPO160 | TPO160 | XRAY | 2.1 | 0.182 | 0.219 | A | 300.0 | 295.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3my5 | 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 | 3MY5C | P24941 | 1 | 296 | 298.0 | RFZ:60301 | Type1 | Active | DFGin | 6.7203 | 15.3826 | BLAminus | -140.83, -171.85 | 49.57, 71.36 | -87.98, 20.89 | 279.16, 71.11 | -63.16, -26.32 | in-in | in | 8.5992 | Saltbr-in | 2.6986 | HRD-in | -80.11, -52.55 | 69.91, 13.09 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9192 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.93, 151.21 | APE9-dihe-na | 70.99, 122.72 | APE8-dihe-in | -51.33, 141.26 | APE8-rot-in | 307.41 | APE67-dihe-in | -61.95, -24.04 | -45.65, -48.3 | APE12-dist-in | 12.7292 | APE11-dist-in | 9.8116 | APE10-dist-in | 6.8134 | APE9-dist-in | 3.2609 | None | TPO160 | TPO160 | XRAY | 2.1 | 0.182 | 0.219 | C | 300.0 | 266.0 | 30 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3my5 | 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 | 3MY5A | P24941 | 1 | 298 | 298.0 | RFZ:60300 | Type1 | Active | DFGin | 6.667 | 15.3481 | BLAminus | -135.55, -178.04 | 53.6, 76.52 | -97.01, 15.67 | 276.61, 75.78 | -59.51, -26.48 | in-in | in | 8.74 | Saltbr-in | 2.7654 | HRD-in | -79.62, -51.44 | 67.18, 13.09 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8831 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.67, 153.77 | APE9-dihe-na | 76.12, 127.46 | APE8-dihe-in | -56.8, 137.09 | APE8-rot-in | 303.01 | APE67-dihe-in | -62.09, -25.12 | -50.14, -44.68 | APE12-dist-in | 13.1416 | APE11-dist-in | 10.346 | APE10-dist-in | 7.1077 | APE9-dist-in | 3.2426 | None | TPO160 | TPO160 | XRAY | 2.1 | 0.182 | 0.219 | A | 300.0 | 295.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3my5 | 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 | 3MY5C | P24941 | 1 | 296 | 298.0 | RFZ:60301 | Type1 | Active | DFGin | 6.7203 | 15.3826 | BLAminus | -140.83, -171.85 | 49.57, 71.36 | -87.98, 20.89 | 279.16, 71.11 | -63.16, -26.32 | in-in | in | 8.5992 | Saltbr-in | 2.6986 | HRD-in | -80.11, -52.55 | 69.91, 13.09 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9192 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.93, 151.21 | APE9-dihe-na | 70.99, 122.72 | APE8-dihe-in | -51.33, 141.26 | APE8-rot-in | 307.41 | APE67-dihe-in | -61.95, -24.04 | -45.65, -48.3 | APE12-dist-in | 12.7292 | APE11-dist-in | 9.8116 | APE10-dist-in | 6.8134 | APE9-dist-in | 3.2609 | None | TPO160 | TPO160 | XRAY | 2.1 | 0.182 | 0.219 | C | 300.0 | 266.0 | 30 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3my5 | 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 |
|---|