| 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 | 2WTVA | O14965 | 125 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.7006 | 9.4543 | None | -75.22, 156.08 | -105.21, 156.98 | 57.55, 45.32 | 319.02, 110.91 | -59.58, -21.68 | out-out | out | 12.2244 | Saltbr-out | 9.7382 | HRD-out | 56.62, 39.51 | -65.34, 136.35 | out-out-out | SNCooo | out-out | ActLoopNT-out | 17.312 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_iioo | APE10-dihe-na | -58.52, -47.8 | APE9-dihe-na | -54.18, -45.12 | APE8-dihe-out | -70.51, -43.3 | APE8-rot-in | 297.14 | APE67-dihe-in | -48.3, -25.92 | -57.93, -45.43 | APE12-dist-in | 8.2869 | APE11-dist-in | 12.3199 | APE10-dist-out | 15.0391 | APE9-dist-out | 12.5887 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | A | 285.0 | 265.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVB | O14965 | 126 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.619 | 9.4225 | None | -74.68, 158.58 | -101.8, 146.26 | 63.97, 49.3 | 317.28, 114.07 | -55.55, -26.4 | out-out | out | 12.4193 | Saltbr-out | 10.2967 | HRD-out | -138.44, 123.91 | -119.97, 134.75 | out-out-out | SNCooo | out-out | ActLoopNT-out | 19.5109 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | 85.02, 1.5 | APE9-dihe-na | 116.84, -135.44 | APE8-dihe-in | -82.25, 112.82 | APE8-rot-in | 306.92 | APE67-dihe-in | -64.29, -12.84 | -49.83, -55.07 | APE12-dist-out | 14.754 | APE11-dist-out | 14.7502 | APE10-dist-out | 12.235 | APE9-dist-out | 12.2869 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | B | 285.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVC | O14965 | 126 | 389 | 403.0 | ZZL:1392 | Type1 | Inactive | DFGinter | 5.6558 | 9.3615 | None | -73.47, 155.34 | -96.85, 146.28 | 67.08, 43.87 | 316.19, 116.1 | -46.77, -31.93 | out-out | out | 12.3893 | Saltbr-out | 10.3055 | HRD-out | -138.88, 125.11 | -124.14, 137.81 | out-out-out | SNCooo | out-out | ActLoopNT-out | 19.519 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | 85.46, 1.21 | APE9-dihe-na | 119.13, -135.87 | APE8-dihe-in | -82.97, 108.09 | APE8-rot-in | 299.33 | APE67-dihe-in | -62.27, -12.5 | -42.96, -58.15 | APE12-dist-out | 14.7656 | APE11-dist-out | 14.7278 | APE10-dist-out | 12.2667 | APE9-dist-out | 12.403 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | C | 285.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVD | O14965 | 125 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.688 | 9.4465 | None | -74.49, 159.41 | -108.43, 161.13 | 55.07, 43.29 | 317.21, 115.65 | -58.54, -27.22 | out-out | out | 12.1938 | Saltbr-out | 9.7964 | HRD-out | 49.31, 42.91 | -68.48, 131.43 | out-out-out | SNCooo | out-out | ActLoopNT-out | 17.0587 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_iioo | APE10-dihe-na | -57.61, -41.18 | APE9-dihe-na | -56.01, -51.32 | APE8-dihe-out | -76.54, -36.16 | APE8-rot-out | 70.56 | APE67-dihe-in | -47.19, -33.07 | -56.26, -46.95 | APE12-dist-in | 8.3139 | APE11-dist-in | 12.4802 | APE10-dist-out | 15.096 | APE9-dist-out | 12.4934 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | D | 285.0 | 265.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVA | O14965 | 125 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.7006 | 9.4543 | None | -75.22, 156.08 | -105.21, 156.98 | 57.55, 45.32 | 319.02, 110.91 | -59.58, -21.68 | out-out | out | 12.2244 | Saltbr-out | 9.7382 | HRD-out | 56.62, 39.51 | -65.34, 136.35 | out-out-out | SNCooo | out-out | ActLoopNT-out | 17.312 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_iioo | APE10-dihe-na | -58.52, -47.8 | APE9-dihe-na | -54.18, -45.12 | APE8-dihe-out | -70.51, -43.3 | APE8-rot-in | 297.14 | APE67-dihe-in | -48.3, -25.92 | -57.93, -45.43 | APE12-dist-in | 8.2869 | APE11-dist-in | 12.3199 | APE10-dist-out | 15.0391 | APE9-dist-out | 12.5887 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | A | 285.0 | 265.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVB | O14965 | 126 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.619 | 9.4225 | None | -74.68, 158.58 | -101.8, 146.26 | 63.97, 49.3 | 317.28, 114.07 | -55.55, -26.4 | out-out | out | 12.4193 | Saltbr-out | 10.2967 | HRD-out | -138.44, 123.91 | -119.97, 134.75 | out-out-out | SNCooo | out-out | ActLoopNT-out | 19.5109 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | 85.02, 1.5 | APE9-dihe-na | 116.84, -135.44 | APE8-dihe-in | -82.25, 112.82 | APE8-rot-in | 306.92 | APE67-dihe-in | -64.29, -12.84 | -49.83, -55.07 | APE12-dist-out | 14.754 | APE11-dist-out | 14.7502 | APE10-dist-out | 12.235 | APE9-dist-out | 12.2869 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | B | 285.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVC | O14965 | 126 | 389 | 403.0 | ZZL:1392 | Type1 | Inactive | DFGinter | 5.6558 | 9.3615 | None | -73.47, 155.34 | -96.85, 146.28 | 67.08, 43.87 | 316.19, 116.1 | -46.77, -31.93 | out-out | out | 12.3893 | Saltbr-out | 10.3055 | HRD-out | -138.88, 125.11 | -124.14, 137.81 | out-out-out | SNCooo | out-out | ActLoopNT-out | 19.519 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | 85.46, 1.21 | APE9-dihe-na | 119.13, -135.87 | APE8-dihe-in | -82.97, 108.09 | APE8-rot-in | 299.33 | APE67-dihe-in | -62.27, -12.5 | -42.96, -58.15 | APE12-dist-out | 14.7656 | APE11-dist-out | 14.7278 | APE10-dist-out | 12.2667 | APE9-dist-out | 12.403 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | C | 285.0 | 264.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 | 2WTVD | O14965 | 125 | 389 | 403.0 | ZZL:1390 | Type1 | Inactive | DFGinter | 5.688 | 9.4465 | None | -74.49, 159.41 | -108.43, 161.13 | 55.07, 43.29 | 317.21, 115.65 | -58.54, -27.22 | out-out | out | 12.1938 | Saltbr-out | 9.7964 | HRD-out | 49.31, 42.91 | -68.48, 131.43 | out-out-out | SNCooo | out-out | ActLoopNT-out | 17.0587 | ActLoopCT-out | nonTYR | APEdihe_aaooi | APEdist_iioo | APE10-dihe-na | -57.61, -41.18 | APE9-dihe-na | -56.01, -51.32 | APE8-dihe-out | -76.54, -36.16 | APE8-rot-out | 70.56 | APE67-dihe-in | -47.19, -33.07 | -56.26, -46.95 | APE12-dist-in | 8.3139 | APE11-dist-in | 12.4802 | APE10-dist-out | 15.096 | APE9-dist-out | 12.4934 | L215R,T217E,R220K | TPO287,TPO288 | TPO287,TPO288,CME290 | XRAY | 2.4 | 0.167 | 0.211 | D | 285.0 | 265.0 | 0 | 26 | 26 | 0 | [[133, 383]] | 1.0 | 2wtv | Homo sapiens | CAMK_AURKA_HUMAN | CAMK | 2.7e-81 | 278.6 | 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 |
|---|