| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | AURKC | AURKC_HUMAN | 9ESAAAA | Q9UQB9 | 32 | 306 | 309.0 | No_ligand | No_ligand | Inactive | DFGin | 5.433 | 16.8828 | ABAminus | -62.04, -28.72 | 179.07, -174.45 | -88.67, 25.64 | 294.85, 94.62 | 59.44, 60.75 | out-out | out | 11.3792 | Saltbr-out | 8.8619 | HRD-out | -140.44, 154.82 | -61.27, 119.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.2764 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -58.98, -22.6 | APE9-dihe-na | 75.42, 33.12 | APE8-dihe-out | -119.6, 19.25 | APE8-rot-out | 46.66 | APE67-dihe-in | -59.85, -36.1 | -64.53, -29.05 | APE12-dist-out | 23.1027 | APE11-dist-out | 21.9403 | APE10-dist-out | 18.0516 | APE9-dist-out | 17.1844 | R195A,R196A,K197A | None | None | XRAY | 2.8 | 0.231 | 0.294 | AAA | 303.0 | 275.0 | 0 | 26 | 26 | 0 | [[43, 293]] | 1.0 | 9esa | CAMK_AURKC_HUMAN | CAMK | 3.9e-80 | 274.8 | 1.0 | 256.0 | 256.0 | 183 | 184 | 185 | 187 | 189 | 72 | 91 | 95 | 163 | 165 | 164 | 166.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 121 | Aurora kinase C |
| CAMK | AURKC | AURKC_HUMAN | 9ESABBB | Q9UQB9 | 32 | 306 | 309.0 | No_ligand | No_ligand | Inactive | DFGin | 5.4344 | 16.8397 | ABAminus | -61.93, -28.95 | 178.73, -174.57 | -88.56, 24.83 | 295.03, 94.88 | 59.52, 60.63 | out-out | out | 11.3511 | Saltbr-out | 8.4349 | HRD-out | -140.0, 154.34 | -60.35, 118.62 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.3227 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -60.23, -20.83 | APE9-dihe-na | 74.99, 33.76 | APE8-dihe-out | -117.9, 10.6 | APE8-rot-in | 259.04 | APE67-dihe-in | -59.49, -36.48 | -65.18, -28.76 | APE12-dist-out | 23.1568 | APE11-dist-out | 21.9757 | APE10-dist-out | 18.0724 | APE9-dist-out | 17.2239 | R195A,R196A,K197A | None | None | XRAY | 2.8 | 0.231 | 0.294 | BBB | 303.0 | 275.0 | 0 | 26 | 26 | 0 | [[43, 293]] | 1.0 | 9esa | CAMK_AURKC_HUMAN | CAMK | 3.9e-80 | 274.8 | 1.0 | 256.0 | 256.0 | 183 | 184 | 185 | 187 | 189 | 72 | 91 | 95 | 163 | 165 | 164 | 166.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 121 | Aurora kinase C |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | AURKC | AURKC_HUMAN | 9ESAAAA | Q9UQB9 | 32 | 306 | 309.0 | No_ligand | No_ligand | Inactive | DFGin | 5.433 | 16.8828 | ABAminus | -62.04, -28.72 | 179.07, -174.45 | -88.67, 25.64 | 294.85, 94.62 | 59.44, 60.75 | out-out | out | 11.3792 | Saltbr-out | 8.8619 | HRD-out | -140.44, 154.82 | -61.27, 119.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.2764 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -58.98, -22.6 | APE9-dihe-na | 75.42, 33.12 | APE8-dihe-out | -119.6, 19.25 | APE8-rot-out | 46.66 | APE67-dihe-in | -59.85, -36.1 | -64.53, -29.05 | APE12-dist-out | 23.1027 | APE11-dist-out | 21.9403 | APE10-dist-out | 18.0516 | APE9-dist-out | 17.1844 | R195A,R196A,K197A | None | None | XRAY | 2.8 | 0.231 | 0.294 | AAA | 303.0 | 275.0 | 0 | 26 | 26 | 0 | [[43, 293]] | 1.0 | 9esa | Homo sapiens | CAMK_AURKC_HUMAN | CAMK | 3.9e-80 | 274.8 | 1.0 | 256.0 | 256.0 | 183 | 184 | 185 | 187 | 189 | 72 | 91 | 95 | 163 | 165 | 164 | 166.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 121 | Aurora kinase C |
| CAMK | AURKC | AURKC_HUMAN | 9ESABBB | Q9UQB9 | 32 | 306 | 309.0 | No_ligand | No_ligand | Inactive | DFGin | 5.4344 | 16.8397 | ABAminus | -61.93, -28.95 | 178.73, -174.57 | -88.56, 24.83 | 295.03, 94.88 | 59.52, 60.63 | out-out | out | 11.3511 | Saltbr-out | 8.4349 | HRD-out | -140.0, 154.34 | -60.35, 118.62 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.3227 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -60.23, -20.83 | APE9-dihe-na | 74.99, 33.76 | APE8-dihe-out | -117.9, 10.6 | APE8-rot-in | 259.04 | APE67-dihe-in | -59.49, -36.48 | -65.18, -28.76 | APE12-dist-out | 23.1568 | APE11-dist-out | 21.9757 | APE10-dist-out | 18.0724 | APE9-dist-out | 17.2239 | R195A,R196A,K197A | None | None | XRAY | 2.8 | 0.231 | 0.294 | BBB | 303.0 | 275.0 | 0 | 26 | 26 | 0 | [[43, 293]] | 1.0 | 9esa | Homo sapiens | CAMK_AURKC_HUMAN | CAMK | 3.9e-80 | 274.8 | 1.0 | 256.0 | 256.0 | 183 | 184 | 185 | 187 | 189 | 72 | 91 | 95 | 163 | 165 | 164 | 166.0 | 221 | 209 | 204 | 203 | 202 | 201 | 200 | 199 | 198 | 121 | Aurora kinase C |
| 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 |
|---|