| 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 | 4C3PD | O14965 | 125 | 390 | 403.0 | ACP:1391 | ATPlike | Inactive | DFGin | 5.0797 | 15.0907 | ABAminus | -119.78, -23.96 | -110.92, 146.31 | -144.29, 22.56 | 288.75, 97.88 | -63.46, -34.21 | out-out | out | 11.1639 | Saltbr-out | 5.9729 | HRD-out | -75.78, -41.12 | 71.55, -101.13 | out-in-out | SNCoio | in-out | ActLoopNT-in | 3.1113 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nooo | APE10-dihe-na | -140.51, -146.18 | APE9-dihe-na | 83.68, 6.59 | APE8-dihe-out | -140.3, 13.24 | APE8-rot-out | 207.12 | APE67-dihe-in | -44.87, -30.51 | -70.19, -27.98 | APE12-dist-none | 999.0 | APE11-dist-out | 20.8704 | APE10-dist-out | 24.1292 | APE9-dist-out | 28.582 | None | None | None | XRAY | 2.69 | 0.205 | 0.289 | D | 282.0 | 260.0 | 6 | 26 | 20 | 6 | [[133, 383]] | 1.0 | 4c3p | CAMK_AURKA_HUMAN | CAMK | 7.4e-80 | 273.9 | 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 | 4C3PA | O14965 | 125 | 388 | 403.0 | ACP:1389 | ATPlike | Inactive | DFGin | 5.1209 | 15.3112 | None | -143.16, 44.14 | -117.33, -72.7 | 63.16, 22.36 | 309.54, 103.5 | -71.05, -27.42 | out-out | out | 10.7129 | Saltbr-out | 4.9547 | HRD-out | -79.39, 150.41 | -121.39, -68.05 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8189 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -49.34, 122.38 | APE9-dihe-na | 116.03, -35.9 | APE8-dihe-out | -100.65, -0.54 | APE8-rot-out | 177.69 | APE67-dihe-in | -57.5, -32.82 | -45.19, -41.29 | APE12-dist-out | 20.9276 | APE11-dist-out | 21.1759 | APE10-dist-out | 26.1561 | APE9-dist-out | 28.5914 | None | None | None | XRAY | 2.69 | 0.205 | 0.289 | A | 282.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 4c3p | CAMK_AURKA_HUMAN | CAMK | 7.4e-80 | 273.9 | 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 | 4C3PD | O14965 | 125 | 390 | 403.0 | ACP:1391 | ATPlike | Inactive | DFGin | 5.0797 | 15.0907 | ABAminus | -119.78, -23.96 | -110.92, 146.31 | -144.29, 22.56 | 288.75, 97.88 | -63.46, -34.21 | out-out | out | 11.1639 | Saltbr-out | 5.9729 | HRD-out | -75.78, -41.12 | 71.55, -101.13 | out-in-out | SNCoio | in-out | ActLoopNT-in | 3.1113 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_nooo | APE10-dihe-na | -140.51, -146.18 | APE9-dihe-na | 83.68, 6.59 | APE8-dihe-out | -140.3, 13.24 | APE8-rot-out | 207.12 | APE67-dihe-in | -44.87, -30.51 | -70.19, -27.98 | APE12-dist-none | 999.0 | APE11-dist-out | 20.8704 | APE10-dist-out | 24.1292 | APE9-dist-out | 28.582 | None | None | None | XRAY | 2.69 | 0.205 | 0.289 | D | 282.0 | 260.0 | 6 | 26 | 20 | 6 | [[133, 383]] | 1.0 | 4c3p | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 7.4e-80 | 273.9 | 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 | 4C3PA | O14965 | 125 | 388 | 403.0 | ACP:1389 | ATPlike | Inactive | DFGin | 5.1209 | 15.3112 | None | -143.16, 44.14 | -117.33, -72.7 | 63.16, 22.36 | 309.54, 103.5 | -71.05, -27.42 | out-out | out | 10.7129 | Saltbr-out | 4.9547 | HRD-out | -79.39, 150.41 | -121.39, -68.05 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8189 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_oooo | APE10-dihe-na | -49.34, 122.38 | APE9-dihe-na | 116.03, -35.9 | APE8-dihe-out | -100.65, -0.54 | APE8-rot-out | 177.69 | APE67-dihe-in | -57.5, -32.82 | -45.19, -41.29 | APE12-dist-out | 20.9276 | APE11-dist-out | 21.1759 | APE10-dist-out | 26.1561 | APE9-dist-out | 28.5914 | None | None | None | XRAY | 2.69 | 0.205 | 0.289 | A | 282.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 4c3p | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 7.4e-80 | 273.9 | 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 |
|---|