| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP3K5 | M3K5_HUMAN | 5UORA | Q99683 | 671 | 939 | 1374.0 | 8GV:1002 | Type1 | Inactive | DFGin | 6.2851 | 13.6338 | BLAminus | -134.65, 172.67 | 64.32, 97.84 | -109.08, 20.19 | 301.0, 92.78 | -63.64, -23.3 | in-in | in | 8.6104 | Saltbr-in | 2.949 | HRD-in | -71.8, -45.36 | 73.85, 8.78 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8264 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nooi | APE10-dihe-na | -118.5, 140.85 | APE9-dihe-na | -76.55, -167.59 | APE8-dihe-in | -50.1, 126.77 | APE8-rot-in | 307.11 | APE67-dihe-in | -83.03, -7.05 | -61.2, -41.39 | APE12-dist-none | 999.0 | APE11-dist-out | 7.1809 | APE10-dist-out | 10.383 | APE9-dist-in | 4.1256 | None | None | None | XRAY | 2.75 | 0.205 | 0.267 | A | 270.0 | 249.0 | 20 | 28 | 19 | 9 | [[678, 938]] | 1.0 | 5uor | STE_MAP3K5_HUMAN | STE | 4.4e-81 | 278.0 | 5.0 | 257.0 | 253.0 | 821 | 822 | 823 | 825 | 827 | 709 | 725 | 729 | 800 | 802 | 801 | 803.0 | 863 | 849 | 844 | 843 | 842 | 841 | 840 | 839 | 838 | 755 | Mitogen-activated protein kinase kinase kinase 5 |
| STE | MAP3K5 | M3K5_HUMAN | 5UORB | Q99683 | 670 | 939 | 1374.0 | 8GV:1002 | Type1 | Inactive | DFGin | 6.7503 | 13.9098 | BLAminus | -134.49, 175.22 | 58.2, 82.47 | -94.06, 20.8 | 300.48, 89.65 | -68.28, -20.03 | in-in | in | 8.2799 | Saltbr-in | 2.7238 | HRD-in | -77.75, -45.92 | 73.94, 0.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3742 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -135.92, 146.73 | APE9-dihe-na | -84.86, -151.59 | APE8-dihe-in | -81.41, 127.68 | APE8-rot-in | 321.22 | APE67-dihe-in | -73.68, -9.98 | -53.85, -46.25 | APE12-dist-in | 10.1913 | APE11-dist-out | 6.1069 | APE10-dist-out | 10.0463 | APE9-dist-in | 3.9203 | None | None | None | XRAY | 2.75 | 0.205 | 0.267 | B | 270.0 | 262.0 | 8 | 28 | 20 | 8 | [[678, 938]] | 1.0 | 5uor | STE_MAP3K5_HUMAN | STE | 4.4e-81 | 278.0 | 5.0 | 257.0 | 253.0 | 821 | 822 | 823 | 825 | 827 | 709 | 725 | 729 | 800 | 802 | 801 | 803.0 | 863 | 849 | 844 | 843 | 842 | 841 | 840 | 839 | 838 | 755 | Mitogen-activated protein kinase kinase kinase 5 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP3K5 | M3K5_HUMAN | 5UORA | Q99683 | 671 | 939 | 1374.0 | 8GV:1002 | Type1 | Inactive | DFGin | 6.2851 | 13.6338 | BLAminus | -134.65, 172.67 | 64.32, 97.84 | -109.08, 20.19 | 301.0, 92.78 | -63.64, -23.3 | in-in | in | 8.6104 | Saltbr-in | 2.949 | HRD-in | -71.8, -45.36 | 73.85, 8.78 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8264 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nooi | APE10-dihe-na | -118.5, 140.85 | APE9-dihe-na | -76.55, -167.59 | APE8-dihe-in | -50.1, 126.77 | APE8-rot-in | 307.11 | APE67-dihe-in | -83.03, -7.05 | -61.2, -41.39 | APE12-dist-none | 999.0 | APE11-dist-out | 7.1809 | APE10-dist-out | 10.383 | APE9-dist-in | 4.1256 | None | None | None | XRAY | 2.75 | 0.205 | 0.267 | A | 270.0 | 249.0 | 20 | 28 | 19 | 9 | [[678, 938]] | 1.0 | 5uor | Homo sapiens | STE_MAP3K5_HUMAN | STE | 4.4e-81 | 278.0 | 5.0 | 257.0 | 253.0 | 821 | 822 | 823 | 825 | 827 | 709 | 725 | 729 | 800 | 802 | 801 | 803.0 | 863 | 849 | 844 | 843 | 842 | 841 | 840 | 839 | 838 | 755 | Mitogen-activated protein kinase kinase kinase 5 |
| STE | MAP3K5 | M3K5_HUMAN | 5UORB | Q99683 | 670 | 939 | 1374.0 | 8GV:1002 | Type1 | Inactive | DFGin | 6.7503 | 13.9098 | BLAminus | -134.49, 175.22 | 58.2, 82.47 | -94.06, 20.8 | 300.48, 89.65 | -68.28, -20.03 | in-in | in | 8.2799 | Saltbr-in | 2.7238 | HRD-in | -77.75, -45.92 | 73.94, 0.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3742 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -135.92, 146.73 | APE9-dihe-na | -84.86, -151.59 | APE8-dihe-in | -81.41, 127.68 | APE8-rot-in | 321.22 | APE67-dihe-in | -73.68, -9.98 | -53.85, -46.25 | APE12-dist-in | 10.1913 | APE11-dist-out | 6.1069 | APE10-dist-out | 10.0463 | APE9-dist-in | 3.9203 | None | None | None | XRAY | 2.75 | 0.205 | 0.267 | B | 270.0 | 262.0 | 8 | 28 | 20 | 8 | [[678, 938]] | 1.0 | 5uor | Homo sapiens | STE_MAP3K5_HUMAN | STE | 4.4e-81 | 278.0 | 5.0 | 257.0 | 253.0 | 821 | 822 | 823 | 825 | 827 | 709 | 725 | 729 | 800 | 802 | 801 | 803.0 | 863 | 849 | 844 | 843 | 842 | 841 | 840 | 839 | 838 | 755 | Mitogen-activated protein kinase kinase kinase 5 |
| 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 |
|---|