| 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 | 3W2CC | O14965 | 128 | 388 | 403.0 | N15:401 | Type1 | Inactive | None | 999.0 | 999.0 | None | -119.65, 152.46 | 84.37, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 13.8507 | Saltbr-out | 14.4223 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-none | SNConn | none-none | ActLoopNT-none | 999.0 | 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, -102.95 | APE8-rot-in | 346.67 | APE67-dihe-in | -33.77, -43.59 | -64.85, -45.2 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | C | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CE | O14965 | 128 | 388 | 403.0 | N15:401 | Type1 | Inactive | None | 999.0 | 999.0 | None | -123.91, 159.82 | 65.31, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 12.9062 | Saltbr-out | 10.7606 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-none | SNConn | none-none | ActLoopNT-none | 999.0 | 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, -62.35 | APE8-rot-in | 314.5 | APE67-dihe-in | -33.57, -39.05 | -86.05, -41.15 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | E | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CA | O14965 | 128 | 388 | 403.0 | N15:401 | Type1.5_Back | Inactive | None | 999.0 | 999.0 | None | -119.68, 158.18 | 72.13, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 13.333 | Saltbr-out | 13.2922 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -105.03 | APE8-rot-out | 176.61 | APE67-dihe-in | -28.13, -45.18 | -62.37, -55.62 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | A | 261.0 | 203.0 | 58 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CG | O14965 | 128 | 388 | 403.0 | N15:401 | Type1.5_Back | Inactive | None | 999.0 | 999.0 | None | -124.56, -177.92 | 59.84, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 12.9554 | Saltbr-out | 11.8849 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -79.06 | APE8-rot-out | 175.53 | APE67-dihe-in | -38.36, -27.94 | -71.96, -40.41 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | G | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CC | O14965 | 128 | 388 | 403.0 | N15:401 | Type1 | Inactive | None | 999.0 | 999.0 | None | -119.65, 152.46 | 84.37, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 13.8507 | Saltbr-out | 14.4223 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-none | SNConn | none-none | ActLoopNT-none | 999.0 | 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, -102.95 | APE8-rot-in | 346.67 | APE67-dihe-in | -33.77, -43.59 | -64.85, -45.2 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | C | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CE | O14965 | 128 | 388 | 403.0 | N15:401 | Type1 | Inactive | None | 999.0 | 999.0 | None | -123.91, 159.82 | 65.31, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 12.9062 | Saltbr-out | 10.7606 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-none | SNConn | none-none | ActLoopNT-none | 999.0 | 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, -62.35 | APE8-rot-in | 314.5 | APE67-dihe-in | -33.57, -39.05 | -86.05, -41.15 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | E | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CA | O14965 | 128 | 388 | 403.0 | N15:401 | Type1.5_Back | Inactive | None | 999.0 | 999.0 | None | -119.68, 158.18 | 72.13, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 13.333 | Saltbr-out | 13.2922 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -105.03 | APE8-rot-out | 176.61 | APE67-dihe-in | -28.13, -45.18 | -62.37, -55.62 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | A | 261.0 | 203.0 | 58 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 | 3W2CG | O14965 | 128 | 388 | 403.0 | N15:401 | Type1.5_Back | Inactive | None | 999.0 | 999.0 | None | -124.56, -177.92 | 59.84, 999.0 | 999.0, 999.0 | 999.0, 999.0 | 999.0, 999.0 | out-out | out | 12.9554 | Saltbr-out | 11.8849 | HRD-none | 999.0, 999.0 | 999.0, 999.0 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -79.06 | APE8-rot-out | 175.53 | APE67-dihe-in | -38.36, -27.94 | -71.96, -40.41 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.45 | 0.256 | 0.32 | G | 261.0 | 202.0 | 59 | 26 | 9 | 17 | [[133, 383]] | 1.0 | 3w2c | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 5.5e-80 | 274.3 | 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 |
|---|