| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | ERBB2 | ERBB2_HUMAN | AF-P04626-K1A | P04626 | 712 | 986 | 1255.0 | No_ligand | No_ligand | Active | DFGin | 6.5639 | 14.0171 | BLAminus | -144.66, -176.12 | 61.8, 62.85 | -78.34, 15.78 | 291.35, 91.75 | -63.64, -22.88 | in-in | in | 8.945 | Saltbr-in | 2.7188 | HRD-in | -76.17, -43.33 | 68.24, -14.48 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8437 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -69.2, 132.85 | APE9-dihe-in | -133.68, 146.19 | APE8-dihe-in | -82.15, 71.71 | APE8-rot-na | 35.76 | APE67-dihe-in | -70.12, -10.82 | -41.93, -41.36 | APE12-dist-na | 11.3675 | APE11-dist-na | 9.7059 | APE10-dist-na | 10.5198 | APE9-dist-in | 6.6372 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 275.0 | 275.0 | 0 | 30 | 30 | 0 | [[720, 978]] | 1.0 | AF-P04626-K1 | TYR_ERBB2_HUMAN | TYR | 4.1e-86 | 294.4 | 2.0 | 260.0 | 259.0 | 862 | 863 | 864 | 866 | 868 | 753 | 770 | 774 | 842 | 844 | 843 | 845.0 | 904 | 892 | 887 | 886 | 885 | 884 | 883 | 882 | 881 | 799 | Receptor tyrosine-protein kinase erbB-2 |
| TYR | ERBB2 | ERBB2_HUMAN | AF-P04626-K3A | P04626 | 712 | 986 | 1255.0 | No_ligand | No_ligand | Active | DFGin | 6.1285 | 14.6813 | BLAminus | -146.79, -169.62 | 57.65, 68.57 | -82.73, 14.22 | 294.24, 97.83 | -60.74, -26.87 | in-in | in | 8.8948 | Saltbr-in | 2.725 | HRD-in | -80.22, -44.01 | 67.05, -11.61 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.861 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -74.14, 131.07 | APE9-dihe-in | -137.06, 151.46 | APE8-dihe-in | -81.74, 64.34 | APE8-rot-na | 38.16 | APE67-dihe-in | -68.22, -12.83 | -42.92, -40.11 | APE12-dist-na | 11.3414 | APE11-dist-na | 9.5334 | APE10-dist-na | 9.9419 | APE9-dist-in | 6.1805 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 275.0 | 275.0 | 0 | 30 | 30 | 0 | [[720, 978]] | 1.0 | AF-P04626-K3 | TYR_ERBB2_HUMAN | TYR | 4.1e-86 | 294.4 | 2.0 | 260.0 | 259.0 | 862 | 863 | 864 | 866 | 868 | 753 | 770 | 774 | 842 | 844 | 843 | 845.0 | 904 | 892 | 887 | 886 | 885 | 884 | 883 | 882 | 881 | 799 | Receptor tyrosine-protein kinase erbB-2 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | ERBB2 | ERBB2_HUMAN | AF-P04626-K1A | P04626 | 712 | 986 | 1255.0 | No_ligand | No_ligand | Active | DFGin | 6.5639 | 14.0171 | BLAminus | -144.66, -176.12 | 61.8, 62.85 | -78.34, 15.78 | 291.35, 91.75 | -63.64, -22.88 | in-in | in | 8.945 | Saltbr-in | 2.7188 | HRD-in | -76.17, -43.33 | 68.24, -14.48 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8437 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -69.2, 132.85 | APE9-dihe-in | -133.68, 146.19 | APE8-dihe-in | -82.15, 71.71 | APE8-rot-na | 35.76 | APE67-dihe-in | -70.12, -10.82 | -41.93, -41.36 | APE12-dist-na | 11.3675 | APE11-dist-na | 9.7059 | APE10-dist-na | 10.5198 | APE9-dist-in | 6.6372 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 275.0 | 275.0 | 0 | 30 | 30 | 0 | [[720, 978]] | 1.0 | AF-P04626-K1 | Homo sapiens | TYR_ERBB2_HUMAN | TYR | 4.1e-86 | 294.4 | 2.0 | 260.0 | 259.0 | 862 | 863 | 864 | 866 | 868 | 753 | 770 | 774 | 842 | 844 | 843 | 845.0 | 904 | 892 | 887 | 886 | 885 | 884 | 883 | 882 | 881 | 799 | Receptor tyrosine-protein kinase erbB-2 |
| TYR | ERBB2 | ERBB2_HUMAN | AF-P04626-K3A | P04626 | 712 | 986 | 1255.0 | No_ligand | No_ligand | Active | DFGin | 6.1285 | 14.6813 | BLAminus | -146.79, -169.62 | 57.65, 68.57 | -82.73, 14.22 | 294.24, 97.83 | -60.74, -26.87 | in-in | in | 8.8948 | Saltbr-in | 2.725 | HRD-in | -80.22, -44.01 | 67.05, -11.61 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.861 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -74.14, 131.07 | APE9-dihe-in | -137.06, 151.46 | APE8-dihe-in | -81.74, 64.34 | APE8-rot-na | 38.16 | APE67-dihe-in | -68.22, -12.83 | -42.92, -40.11 | APE12-dist-na | 11.3414 | APE11-dist-na | 9.5334 | APE10-dist-na | 9.9419 | APE9-dist-in | 6.1805 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 275.0 | 275.0 | 0 | 30 | 30 | 0 | [[720, 978]] | 1.0 | AF-P04626-K3 | Homo sapiens | TYR_ERBB2_HUMAN | TYR | 4.1e-86 | 294.4 | 2.0 | 260.0 | 259.0 | 862 | 863 | 864 | 866 | 868 | 753 | 770 | 774 | 842 | 844 | 843 | 845.0 | 904 | 892 | 887 | 886 | 885 | 884 | 883 | 882 | 881 | 799 | Receptor tyrosine-protein kinase erbB-2 |
| 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 |
|---|