| 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 | 9ESZA | P24941 | 1 | 292 | 298.0 | HGW:60601 | Type1 | Active | DFGin | 6.5776 | 15.3324 | BLAminus | -132.04, 171.04 | 63.6, 85.87 | -98.66, 25.0 | 277.0, 76.47 | -70.53, -27.06 | in-in | in | 8.6416 | Saltbr-in | 3.0007 | HRD-in | -80.25, -60.98 | 81.99, 14.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9882 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -71.52, 168.74 | APE9-dihe-na | 75.8, 128.24 | APE8-dihe-in | -49.62, 139.46 | APE8-rot-in | 302.85 | APE67-dihe-in | -59.69, -19.57 | -54.76, -48.33 | APE12-dist-in | 13.123 | APE11-dist-in | 12.0773 | APE10-dist-in | 7.0857 | APE9-dist-in | 3.2484 | None | TPO160 | TPO160 | XRAY | 2.42 | 0.212 | 0.213 | A | 302.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9esz | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | 9ESZC | P24941 | 1 | 296 | 298.0 | HGW:60501 | Type1 | Active | DFGin | 6.6994 | 15.3762 | BLAminus | -138.8, -176.72 | 49.7, 80.72 | -92.52, 24.31 | 277.61, 74.75 | -64.18, -24.0 | in-in | in | 8.4557 | Saltbr-in | 2.9658 | HRD-in | -81.04, -55.78 | 70.54, 14.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8466 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.11, 146.25 | APE9-dihe-na | 77.04, 123.95 | APE8-dihe-in | -50.26, 136.24 | APE8-rot-in | 297.63 | APE67-dihe-in | -54.0, -25.83 | -45.3, -55.89 | APE12-dist-in | 13.0314 | APE11-dist-in | 10.4577 | APE10-dist-in | 7.148 | APE9-dist-in | 3.2502 | None | TPO160 | TPO160 | XRAY | 2.42 | 0.212 | 0.213 | C | 302.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9esz | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | 6Q4AA | P24941 | 1 | 298 | 298.0 | HGW:301 | Type1 | Inactive | None | 11.3058 | 18.4844 | None | -99.64, 151.34 | 71.13, 19.02 | -56.46, 143.53 | 245.43, 97.69 | 75.11, -5.52 | out-out | out | 15.3944 | Saltbr-out | 16.3628 | HRD-in | -87.49, -64.78 | 82.76, -10.85 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8722 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -54.84, 127.77 | APE9-dihe-na | -73.06, 129.93 | APE8-dihe-in | -62.58, 141.11 | APE8-rot-out | 189.02 | APE67-dihe-in | -63.75, -25.74 | -99.36, -2.17 | APE12-dist-out | 21.026 | APE11-dist-out | 17.7543 | APE10-dist-out | 19.3636 | APE9-dist-out | 10.597 | None | None | None | XRAY | 1.13 | 0.184 | 0.22 | A | 306.0 | 292.0 | 6 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6q4a | CMGC_CDK2_HUMAN | CMGC | 7e-90 | 307.7 | 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 | 9ESZA | P24941 | 1 | 292 | 298.0 | HGW:60601 | Type1 | Active | DFGin | 6.5776 | 15.3324 | BLAminus | -132.04, 171.04 | 63.6, 85.87 | -98.66, 25.0 | 277.0, 76.47 | -70.53, -27.06 | in-in | in | 8.6416 | Saltbr-in | 3.0007 | HRD-in | -80.25, -60.98 | 81.99, 14.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9882 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -71.52, 168.74 | APE9-dihe-na | 75.8, 128.24 | APE8-dihe-in | -49.62, 139.46 | APE8-rot-in | 302.85 | APE67-dihe-in | -59.69, -19.57 | -54.76, -48.33 | APE12-dist-in | 13.123 | APE11-dist-in | 12.0773 | APE10-dist-in | 7.0857 | APE9-dist-in | 3.2484 | None | TPO160 | TPO160 | XRAY | 2.42 | 0.212 | 0.213 | A | 302.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9esz | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | 9ESZC | P24941 | 1 | 296 | 298.0 | HGW:60501 | Type1 | Active | DFGin | 6.6994 | 15.3762 | BLAminus | -138.8, -176.72 | 49.7, 80.72 | -92.52, 24.31 | 277.61, 74.75 | -64.18, -24.0 | in-in | in | 8.4557 | Saltbr-in | 2.9658 | HRD-in | -81.04, -55.78 | 70.54, 14.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8466 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.11, 146.25 | APE9-dihe-na | 77.04, 123.95 | APE8-dihe-in | -50.26, 136.24 | APE8-rot-in | 297.63 | APE67-dihe-in | -54.0, -25.83 | -45.3, -55.89 | APE12-dist-in | 13.0314 | APE11-dist-in | 10.4577 | APE10-dist-in | 7.148 | APE9-dist-in | 3.2502 | None | TPO160 | TPO160 | XRAY | 2.42 | 0.212 | 0.213 | C | 302.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9esz | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.7e-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 | 6Q4AA | P24941 | 1 | 298 | 298.0 | HGW:301 | Type1 | Inactive | None | 11.3058 | 18.4844 | None | -99.64, 151.34 | 71.13, 19.02 | -56.46, 143.53 | 245.43, 97.69 | 75.11, -5.52 | out-out | out | 15.3944 | Saltbr-out | 16.3628 | HRD-in | -87.49, -64.78 | 82.76, -10.85 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8722 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -54.84, 127.77 | APE9-dihe-na | -73.06, 129.93 | APE8-dihe-in | -62.58, 141.11 | APE8-rot-out | 189.02 | APE67-dihe-in | -63.75, -25.74 | -99.36, -2.17 | APE12-dist-out | 21.026 | APE11-dist-out | 17.7543 | APE10-dist-out | 19.3636 | APE9-dist-out | 10.597 | None | None | None | XRAY | 1.13 | 0.184 | 0.22 | A | 306.0 | 292.0 | 6 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 6q4a | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 7e-90 | 307.7 | 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 |
|---|