| 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 | 2C5OA | P24941 | 1 | 296 | 298.0 | CK2:1297 | Type1 | Inactive | DFGin | 6.4943 | 15.2899 | BLAminus | -137.74, 173.02 | 58.56, 80.78 | -92.88, 19.82 | 283.21, 65.89 | -51.26, -36.47 | in-in | in | 8.6201 | Saltbr-in | 3.0229 | HRD-in | -83.52, -43.57 | 76.97, -18.17 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9317 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioi | APE10-dihe-na | -99.47, 35.52 | APE9-dihe-na | -88.97, 170.31 | APE8-dihe-in | -57.41, 159.51 | APE8-rot-out | 226.24 | APE67-dihe-in | -53.95, -30.16 | -94.63, -49.34 | APE12-dist-out | 14.6859 | APE11-dist-in | 11.3586 | APE10-dist-out | 9.7926 | APE9-dist-in | 5.5994 | None | None | None | XRAY | 2.1 | 0.197 | 0.256 | A | 298.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2c5o | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 2C5OC | P24941 | 1 | 297 | 298.0 | CK2:1298 | Type1 | Inactive | DFGin | 6.4758 | 15.429 | BLAminus | -144.63, 177.97 | 57.45, 72.75 | -89.52, 20.98 | 280.55, 69.4 | -66.45, -25.41 | in-in | in | 8.5383 | Saltbr-in | 3.095 | HRD-in | -84.92, -44.81 | 82.92, -18.25 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8872 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioi | APE10-dihe-na | -95.84, 39.31 | APE9-dihe-na | -90.01, 169.5 | APE8-dihe-in | -56.49, 156.39 | APE8-rot-out | 222.88 | APE67-dihe-in | -60.8, -32.24 | -97.54, -42.65 | APE12-dist-out | 14.8777 | APE11-dist-in | 11.4236 | APE10-dist-out | 9.9659 | APE9-dist-in | 5.682 | None | None | None | XRAY | 2.1 | 0.197 | 0.256 | C | 298.0 | 297.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2c5o | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 1PXJA | P24941 | 1 | 298 | 298.0 | CK2:500 | Type1 | Inactive | DFGin | 10.238 | 18.3235 | BLBtrans | -108.12, 154.72 | 59.41, 34.48 | -70.19, 130.25 | 212.07, 108.72 | 84.22, -11.22 | out-out | out | 15.0016 | Saltbr-out | 19.4848 | HRD-in | -87.43, -51.91 | 79.87, -15.33 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8198 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -77.98, 124.23 | APE9-dihe-na | -73.35, 137.11 | APE8-dihe-in | -70.59, 144.9 | APE8-rot-out | 191.49 | APE67-dihe-in | -50.02, -34.42 | -112.23, -2.53 | APE12-dist-out | 20.6537 | APE11-dist-out | 17.5888 | APE10-dist-out | 19.2367 | APE9-dist-out | 10.7458 | None | None | None | XRAY | 2.3 | 0.21 | 0.271 | A | 298.0 | 294.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1pxj | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 4FKLA | P24941 | 1 | 298 | 298.0 | CK2:60300 | Type1 | Inactive | DFGin | 10.2983 | 18.4545 | BLBtrans | -97.13, 153.97 | 64.33, 26.38 | -63.89, 127.59 | 213.16, 110.01 | 88.41, -9.74 | out-out | out | 15.1545 | Saltbr-out | 16.3653 | HRD-in | -87.84, -59.51 | 78.56, -8.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8564 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -70.65, 125.71 | APE9-dihe-na | -71.35, 128.91 | APE8-dihe-in | -66.94, 143.31 | APE8-rot-out | 189.68 | APE67-dihe-in | -62.22, -28.04 | -98.08, -4.44 | APE12-dist-out | 20.0097 | APE11-dist-out | 17.2447 | APE10-dist-out | 18.7522 | APE9-dist-out | 10.243 | None | None | None | XRAY | 1.26 | 0.153 | 0.183 | A | 299.0 | 291.0 | 7 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4fkl | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 | 2C5OA | P24941 | 1 | 296 | 298.0 | CK2:1297 | Type1 | Inactive | DFGin | 6.4943 | 15.2899 | BLAminus | -137.74, 173.02 | 58.56, 80.78 | -92.88, 19.82 | 283.21, 65.89 | -51.26, -36.47 | in-in | in | 8.6201 | Saltbr-in | 3.0229 | HRD-in | -83.52, -43.57 | 76.97, -18.17 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9317 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioi | APE10-dihe-na | -99.47, 35.52 | APE9-dihe-na | -88.97, 170.31 | APE8-dihe-in | -57.41, 159.51 | APE8-rot-out | 226.24 | APE67-dihe-in | -53.95, -30.16 | -94.63, -49.34 | APE12-dist-out | 14.6859 | APE11-dist-in | 11.3586 | APE10-dist-out | 9.7926 | APE9-dist-in | 5.5994 | None | None | None | XRAY | 2.1 | 0.197 | 0.256 | A | 298.0 | 296.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2c5o | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 2C5OC | P24941 | 1 | 297 | 298.0 | CK2:1298 | Type1 | Inactive | DFGin | 6.4758 | 15.429 | BLAminus | -144.63, 177.97 | 57.45, 72.75 | -89.52, 20.98 | 280.55, 69.4 | -66.45, -25.41 | in-in | in | 8.5383 | Saltbr-in | 3.095 | HRD-in | -84.92, -44.81 | 82.92, -18.25 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8872 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioi | APE10-dihe-na | -95.84, 39.31 | APE9-dihe-na | -90.01, 169.5 | APE8-dihe-in | -56.49, 156.39 | APE8-rot-out | 222.88 | APE67-dihe-in | -60.8, -32.24 | -97.54, -42.65 | APE12-dist-out | 14.8777 | APE11-dist-in | 11.4236 | APE10-dist-out | 9.9659 | APE9-dist-in | 5.682 | None | None | None | XRAY | 2.1 | 0.197 | 0.256 | C | 298.0 | 297.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2c5o | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 1PXJA | P24941 | 1 | 298 | 298.0 | CK2:500 | Type1 | Inactive | DFGin | 10.238 | 18.3235 | BLBtrans | -108.12, 154.72 | 59.41, 34.48 | -70.19, 130.25 | 212.07, 108.72 | 84.22, -11.22 | out-out | out | 15.0016 | Saltbr-out | 19.4848 | HRD-in | -87.43, -51.91 | 79.87, -15.33 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8198 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -77.98, 124.23 | APE9-dihe-na | -73.35, 137.11 | APE8-dihe-in | -70.59, 144.9 | APE8-rot-out | 191.49 | APE67-dihe-in | -50.02, -34.42 | -112.23, -2.53 | APE12-dist-out | 20.6537 | APE11-dist-out | 17.5888 | APE10-dist-out | 19.2367 | APE9-dist-out | 10.7458 | None | None | None | XRAY | 2.3 | 0.21 | 0.271 | A | 298.0 | 294.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1pxj | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.3e-90 | 307.9 | 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 | 4FKLA | P24941 | 1 | 298 | 298.0 | CK2:60300 | Type1 | Inactive | DFGin | 10.2983 | 18.4545 | BLBtrans | -97.13, 153.97 | 64.33, 26.38 | -63.89, 127.59 | 213.16, 110.01 | 88.41, -9.74 | out-out | out | 15.1545 | Saltbr-out | 16.3653 | HRD-in | -87.84, -59.51 | 78.56, -8.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.8564 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -70.65, 125.71 | APE9-dihe-na | -71.35, 128.91 | APE8-dihe-in | -66.94, 143.31 | APE8-rot-out | 189.68 | APE67-dihe-in | -62.22, -28.04 | -98.08, -4.44 | APE12-dist-out | 20.0097 | APE11-dist-out | 17.2447 | APE10-dist-out | 18.7522 | APE9-dist-out | 10.243 | None | None | None | XRAY | 1.26 | 0.153 | 0.183 | A | 299.0 | 291.0 | 7 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 4fkl | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 6.4e-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 |
|---|