| 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 | 2WIHA | P24941 | 1 | 298 | 298.0 | P48:61299 | Type1 | Inactive | DFGin | 6.3232 | 15.1532 | BLAminus | -141.48, 174.43 | 62.06, 78.82 | -96.32, 29.99 | 282.61, 69.45 | -63.78, -17.45 | in-in | in | 8.8992 | Saltbr-in | 2.7348 | HRD-in | -77.3, -59.72 | 79.63, -0.51 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8674 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -126.75, 155.26 | APE9-dihe-na | -53.97, 153.09 | APE8-dihe-in | -55.51, 151.53 | APE8-rot-out | 190.5 | APE67-dihe-in | -57.21, -28.57 | -52.08, -46.97 | APE12-dist-in | 10.8564 | APE11-dist-out | 6.0999 | APE10-dist-out | 9.3083 | APE9-dist-in | 3.9462 | None | None | None | XRAY | 2.5 | 0.215 | 0.25 | A | 309.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wih | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2WIHC | P24941 | 1 | 298 | 298.0 | P48:61299 | Type1 | Active | DFGin | 6.515 | 15.5019 | BLAminus | -139.53, 171.28 | 64.6, 87.79 | -105.04, 25.11 | 279.58, 71.52 | -58.59, -37.4 | in-in | in | 8.856 | Saltbr-in | 2.9003 | HRD-in | -79.72, -52.5 | 76.18, -5.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9613 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -125.83, -70.3 | APE9-dihe-na | -57.72, 136.41 | APE8-dihe-in | -51.89, 139.14 | APE8-rot-in | 308.59 | APE67-dihe-in | -63.31, -27.96 | -57.76, -40.98 | APE12-dist-in | 13.3621 | APE11-dist-in | 12.02 | APE10-dist-in | 7.0219 | APE9-dist-in | 3.6417 | None | None | None | XRAY | 2.5 | 0.215 | 0.25 | C | 309.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wih | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2WIHA | P24941 | 1 | 298 | 298.0 | P48:61299 | Type1 | Inactive | DFGin | 6.3232 | 15.1532 | BLAminus | -141.48, 174.43 | 62.06, 78.82 | -96.32, 29.99 | 282.61, 69.45 | -63.78, -17.45 | in-in | in | 8.8992 | Saltbr-in | 2.7348 | HRD-in | -77.3, -59.72 | 79.63, -0.51 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8674 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -126.75, 155.26 | APE9-dihe-na | -53.97, 153.09 | APE8-dihe-in | -55.51, 151.53 | APE8-rot-out | 190.5 | APE67-dihe-in | -57.21, -28.57 | -52.08, -46.97 | APE12-dist-in | 10.8564 | APE11-dist-out | 6.0999 | APE10-dist-out | 9.3083 | APE9-dist-in | 3.9462 | None | None | None | XRAY | 2.5 | 0.215 | 0.25 | A | 309.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wih | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 | 2WIHC | P24941 | 1 | 298 | 298.0 | P48:61299 | Type1 | Active | DFGin | 6.515 | 15.5019 | BLAminus | -139.53, 171.28 | 64.6, 87.79 | -105.04, 25.11 | 279.58, 71.52 | -58.59, -37.4 | in-in | in | 8.856 | Saltbr-in | 2.9003 | HRD-in | -79.72, -52.5 | 76.18, -5.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9613 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -125.83, -70.3 | APE9-dihe-na | -57.72, 136.41 | APE8-dihe-in | -51.89, 139.14 | APE8-rot-in | 308.59 | APE67-dihe-in | -63.31, -27.96 | -57.76, -40.98 | APE12-dist-in | 13.3621 | APE11-dist-in | 12.02 | APE10-dist-in | 7.0219 | APE9-dist-in | 3.6417 | None | None | None | XRAY | 2.5 | 0.215 | 0.25 | C | 309.0 | 298.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 2wih | Homo sapiens | CMGC_CDK2_HUMAN | CMGC | 7.3e-90 | 307.6 | 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 |
|---|