| 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 | AURKA | AURKA_HUMAN | 8SSOA | O14965 | 127 | 389 | 403.0 | 627:503 | Type1 | Inactive | DFGinter | 5.3986 | 10.215 | None | -108.08, -33.36 | 50.1, -154.98 | 50.19, 34.56 | 301.31, 89.86 | -57.19, -31.19 | out-out | out | 12.3336 | Saltbr-out | 8.6183 | HRD-out | 58.03, 59.93 | -81.1, 151.47 | out-out-out | SNCooo | out-out | ActLoopNT-out | 16.6026 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nooo | APE10-dihe-na | -77.17, 142.4 | APE9-dihe-na | -91.52, -9.13 | APE8-dihe-out | -58.73, -51.63 | APE8-rot-in | 325.37 | APE67-dihe-in | -60.47, -22.49 | -51.35, -46.12 | APE12-dist-none | 999.0 | APE11-dist-out | 14.2442 | APE10-dist-out | 9.6966 | APE9-dist-out | 11.7439 | None | None | None | XRAY | 1.97 | 0.194 | 0.234 | A | 285.0 | 256.0 | 7 | 26 | 19 | 7 | [[133, 383]] | 1.0 | 8sso | CAMK_AURKA_HUMAN | CAMK | 7.7e-80 | 273.8 | 1.0 | 256.0 | 256.0 | 273 | 274 | 275 | 277 | 279 | 162 | 181 | 185 | 253 | 255 | 254 | 256.0 | 311 | 299 | 294 | 293 | 292 | 291 | 290 | 289 | 288 | 211 | Aurora kinase A |
| CAMK | AURKA | AURKA_HUMAN | 8SSOD | O14965 | 127 | 389 | 403.0 | 627:501 | Type1 | Inactive | DFGinter | 5.2809 | 10.1223 | None | -105.7, -31.6 | 53.01, -156.16 | 52.08, 37.65 | 306.05, 89.37 | -57.92, -31.1 | out-out | out | 12.2914 | Saltbr-out | 8.4761 | HRD-out | 56.18, 68.26 | -87.55, 151.34 | out-out-none | SNCoon | out-none | ActLoopNT-out | 16.7335 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -51.48 | APE8-rot-in | 286.23 | APE67-dihe-in | -64.32, -21.7 | -60.98, -32.62 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 1.97 | 0.194 | 0.234 | D | 285.0 | 252.0 | 11 | 26 | 15 | 11 | [[133, 383]] | 1.0 | 8sso | CAMK_AURKA_HUMAN | CAMK | 7.7e-80 | 273.8 | 1.0 | 256.0 | 256.0 | 273 | 274 | 275 | 277 | 279 | 162 | 181 | 185 | 253 | 255 | 254 | 256.0 | 311 | 299 | 294 | 293 | 292 | 291 | 290 | 289 | 288 | 211 | Aurora kinase A |
| 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 | AURKA | AURKA_HUMAN | 8SSOA | O14965 | 127 | 389 | 403.0 | 627:503 | Type1 | Inactive | DFGinter | 5.3986 | 10.215 | None | -108.08, -33.36 | 50.1, -154.98 | 50.19, 34.56 | 301.31, 89.86 | -57.19, -31.19 | out-out | out | 12.3336 | Saltbr-out | 8.6183 | HRD-out | 58.03, 59.93 | -81.1, 151.47 | out-out-out | SNCooo | out-out | ActLoopNT-out | 16.6026 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nooo | APE10-dihe-na | -77.17, 142.4 | APE9-dihe-na | -91.52, -9.13 | APE8-dihe-out | -58.73, -51.63 | APE8-rot-in | 325.37 | APE67-dihe-in | -60.47, -22.49 | -51.35, -46.12 | APE12-dist-none | 999.0 | APE11-dist-out | 14.2442 | APE10-dist-out | 9.6966 | APE9-dist-out | 11.7439 | None | None | None | XRAY | 1.97 | 0.194 | 0.234 | A | 285.0 | 256.0 | 7 | 26 | 19 | 7 | [[133, 383]] | 1.0 | 8sso | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 7.7e-80 | 273.8 | 1.0 | 256.0 | 256.0 | 273 | 274 | 275 | 277 | 279 | 162 | 181 | 185 | 253 | 255 | 254 | 256.0 | 311 | 299 | 294 | 293 | 292 | 291 | 290 | 289 | 288 | 211 | Aurora kinase A |
| CAMK | AURKA | AURKA_HUMAN | 8SSOD | O14965 | 127 | 389 | 403.0 | 627:501 | Type1 | Inactive | DFGinter | 5.2809 | 10.1223 | None | -105.7, -31.6 | 53.01, -156.16 | 52.08, 37.65 | 306.05, 89.37 | -57.92, -31.1 | out-out | out | 12.2914 | Saltbr-out | 8.4761 | HRD-out | 56.18, 68.26 | -87.55, 151.34 | out-out-none | SNCoon | out-none | ActLoopNT-out | 16.7335 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -51.48 | APE8-rot-in | 286.23 | APE67-dihe-in | -64.32, -21.7 | -60.98, -32.62 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 1.97 | 0.194 | 0.234 | D | 285.0 | 252.0 | 11 | 26 | 15 | 11 | [[133, 383]] | 1.0 | 8sso | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 7.7e-80 | 273.8 | 1.0 | 256.0 | 256.0 | 273 | 274 | 275 | 277 | 279 | 162 | 181 | 185 | 253 | 255 | 254 | 256.0 | 311 | 299 | 294 | 293 | 292 | 291 | 290 | 289 | 288 | 211 | Aurora kinase A |
| 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 |
|---|