| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | AKT1 | AKT1_HUMAN | 3OCBA | P31749 | 144 | 478 | 480.0 | XM1:1 | Type1 | Active | DFGin | 6.6382 | 13.8031 | BLAminus | -116.95, 176.33 | 66.85, 80.21 | -101.71, 15.06 | 291.18, 80.12 | -62.95, -27.15 | in-in | in | 8.7712 | Saltbr-in | 2.7698 | HRD-in | -68.69, -47.69 | 74.78, -17.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9855 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.18, 163.1 | APE9-dihe-na | 135.15, -135.96 | APE8-dihe-in | -136.2, 122.51 | APE8-rot-in | 298.45 | APE67-dihe-in | -66.42, -19.48 | -44.24, -42.98 | APE12-dist-in | 8.435 | APE11-dist-in | 11.4893 | APE10-dist-in | 5.8878 | APE9-dist-in | 4.0576 | S473D | TPO308 | TPO308 | XRAY | 2.7 | 0.217 | 0.282 | A | 341.0 | 316.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3ocb | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | AKT1 | AKT1_HUMAN | 3OCBB | P31749 | 144 | 478 | 480.0 | XM1:2 | Type1 | Active | DFGin | 6.3319 | 13.3989 | BLAminus | -134.12, 162.45 | 65.57, 102.27 | -117.67, 11.66 | 296.51, 86.34 | -58.99, -28.22 | in-in | in | 8.8145 | Saltbr-in | 2.8714 | HRD-in | -68.9, -44.89 | 75.11, -22.64 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0783 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.43, 165.77 | APE9-dihe-na | 133.07, -137.47 | APE8-dihe-in | -130.52, 128.21 | APE8-rot-in | 301.82 | APE67-dihe-in | -61.46, -22.02 | -42.63, -52.7 | APE12-dist-in | 8.7315 | APE11-dist-in | 11.6029 | APE10-dist-in | 6.079 | APE9-dist-in | 4.1337 | S473D | TPO308 | TPO308 | XRAY | 2.7 | 0.217 | 0.282 | B | 341.0 | 320.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3ocb | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | AKT1 | AKT1_HUMAN | 3OCBA | P31749 | 144 | 478 | 480.0 | XM1:1 | Type1 | Active | DFGin | 6.6382 | 13.8031 | BLAminus | -116.95, 176.33 | 66.85, 80.21 | -101.71, 15.06 | 291.18, 80.12 | -62.95, -27.15 | in-in | in | 8.7712 | Saltbr-in | 2.7698 | HRD-in | -68.69, -47.69 | 74.78, -17.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9855 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.18, 163.1 | APE9-dihe-na | 135.15, -135.96 | APE8-dihe-in | -136.2, 122.51 | APE8-rot-in | 298.45 | APE67-dihe-in | -66.42, -19.48 | -44.24, -42.98 | APE12-dist-in | 8.435 | APE11-dist-in | 11.4893 | APE10-dist-in | 5.8878 | APE9-dist-in | 4.0576 | S473D | TPO308 | TPO308 | XRAY | 2.7 | 0.217 | 0.282 | A | 341.0 | 316.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3ocb | Homo sapiens | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| AGC | AKT1 | AKT1_HUMAN | 3OCBB | P31749 | 144 | 478 | 480.0 | XM1:2 | Type1 | Active | DFGin | 6.3319 | 13.3989 | BLAminus | -134.12, 162.45 | 65.57, 102.27 | -117.67, 11.66 | 296.51, 86.34 | -58.99, -28.22 | in-in | in | 8.8145 | Saltbr-in | 2.8714 | HRD-in | -68.9, -44.89 | 75.11, -22.64 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0783 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -160.43, 165.77 | APE9-dihe-na | 133.07, -137.47 | APE8-dihe-in | -130.52, 128.21 | APE8-rot-in | 301.82 | APE67-dihe-in | -61.46, -22.02 | -42.63, -52.7 | APE12-dist-in | 8.7315 | APE11-dist-in | 11.6029 | APE10-dist-in | 6.079 | APE9-dist-in | 4.1337 | S473D | TPO308 | TPO308 | XRAY | 2.7 | 0.217 | 0.282 | B | 341.0 | 320.0 | 0 | 28 | 28 | 0 | [[150, 408]] | 1.0 | 3ocb | Homo sapiens | AGC_AKT1_HUMAN | AGC | 2.3e-99 | 337.7 | 1.0 | 260.0 | 260.0 | 291 | 292 | 293 | 295 | 297 | 179 | 198 | 202 | 271 | 273 | 272 | 274.0 | 331 | 319 | 314 | 313 | 312 | 311 | 310 | 309 | 308 | 228 | RAC-alpha serine/threonine-protein kinase |
| 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 |
|---|