| 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 | 9ETPC | P24941 | 1 | 296 | 298.0 | BYZ:60501,BYZ:60502,BYZ:60503 | Type1,Allosteric,Allosteric | Active | DFGin | 6.5626 | 15.0258 | BLAminus | -139.85, -178.12 | 50.6, 80.08 | -91.54, 27.1 | 284.21, 67.12 | -60.57, -29.59 | in-in | in | 8.5968 | Saltbr-in | 2.9557 | HRD-in | -84.41, -56.87 | 79.21, 8.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8209 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.1, 146.93 | APE9-dihe-na | 73.24, 128.07 | APE8-dihe-in | -58.4, 133.61 | APE8-rot-in | 297.06 | APE67-dihe-in | -57.21, -23.28 | -33.45, -54.48 | APE12-dist-in | 12.7593 | APE11-dist-in | 9.6652 | APE10-dist-in | 6.8156 | APE9-dist-in | 3.3599 | None | TPO160 | TPO160 | XRAY | 2.48 | 0.202 | 0.231 | C | 302.0 | 279.0 | 17 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9etp | 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 | 9ETPA | P24941 | 1 | 297 | 298.0 | BYZ:60601,BYZ:60603,BYZ:60604,BYZ:60605,BYZ:60606,BYZ:60607 | Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric | Active | DFGin | 6.8397 | 15.4944 | BLAminus | -127.49, -178.48 | 53.77, 85.13 | -106.7, 35.09 | 276.24, 76.74 | -80.48, -25.81 | in-in | in | 8.5464 | Saltbr-in | 3.0455 | HRD-in | -77.4, -56.67 | 72.11, 14.41 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9499 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.24, 146.07 | APE9-dihe-na | 79.12, 126.78 | APE8-dihe-in | -56.13, 139.51 | APE8-rot-in | 303.8 | APE67-dihe-in | -55.08, -20.41 | -52.32, -47.85 | APE12-dist-in | 12.5873 | APE11-dist-in | 9.7655 | APE10-dist-in | 6.8768 | APE9-dist-in | 3.2852 | None | TPO160 | TPO160 | XRAY | 2.48 | 0.202 | 0.231 | A | 302.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9etp | 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 |
| 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 | 9ETPC | P24941 | 1 | 296 | 298.0 | BYZ:60501,BYZ:60502,BYZ:60503 | Type1,Allosteric,Allosteric | Active | DFGin | 6.5626 | 15.0258 | BLAminus | -139.85, -178.12 | 50.6, 80.08 | -91.54, 27.1 | 284.21, 67.12 | -60.57, -29.59 | in-in | in | 8.5968 | Saltbr-in | 2.9557 | HRD-in | -84.41, -56.87 | 79.21, 8.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8209 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.1, 146.93 | APE9-dihe-na | 73.24, 128.07 | APE8-dihe-in | -58.4, 133.61 | APE8-rot-in | 297.06 | APE67-dihe-in | -57.21, -23.28 | -33.45, -54.48 | APE12-dist-in | 12.7593 | APE11-dist-in | 9.6652 | APE10-dist-in | 6.8156 | APE9-dist-in | 3.3599 | None | TPO160 | TPO160 | XRAY | 2.48 | 0.202 | 0.231 | C | 302.0 | 279.0 | 17 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9etp | 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 | 9ETPA | P24941 | 1 | 297 | 298.0 | BYZ:60601,BYZ:60603,BYZ:60604,BYZ:60605,BYZ:60606,BYZ:60607 | Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric | Active | DFGin | 6.8397 | 15.4944 | BLAminus | -127.49, -178.48 | 53.77, 85.13 | -106.7, 35.09 | 276.24, 76.74 | -80.48, -25.81 | in-in | in | 8.5464 | Saltbr-in | 3.0455 | HRD-in | -77.4, -56.67 | 72.11, 14.41 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9499 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -133.24, 146.07 | APE9-dihe-na | 79.12, 126.78 | APE8-dihe-in | -56.13, 139.51 | APE8-rot-in | 303.8 | APE67-dihe-in | -55.08, -20.41 | -52.32, -47.85 | APE12-dist-in | 12.5873 | APE11-dist-in | 9.7655 | APE10-dist-in | 6.8768 | APE9-dist-in | 3.2852 | None | TPO160 | TPO160 | XRAY | 2.48 | 0.202 | 0.231 | A | 302.0 | 294.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 9etp | 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 |
| 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 |
|---|