| 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 | 6VREA | Q99683 | 671 | 940 | 1374.0 | RFG:1002 | Type1 | Inactive | DFGin | 6.8152 | 13.6113 | BLAminus | -129.9, 174.85 | 60.66, 96.18 | -107.07, 14.48 | 299.67, 100.35 | -66.93, -27.63 | in-in | in | 8.337 | Saltbr-in | 2.6983 | HRD-in | -75.62, -47.02 | 73.48, 5.8 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0816 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -116.85, 140.4 | APE9-dihe-na | -80.98, -165.5 | APE8-dihe-in | -71.42, 135.62 | APE8-rot-in | 312.64 | APE67-dihe-in | -74.41, -14.28 | -63.87, -41.58 | APE12-dist-in | 10.791 | APE11-dist-out | 5.4295 | APE10-dist-out | 9.8756 | APE9-dist-in | 3.6996 | None | None | None | XRAY | 2.29 | 0.19 | 0.24 | A | 291.0 | 261.0 | 9 | 28 | 21 | 7 | [[678, 938]] | 1.0 | 6vre | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.7 | 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 | 6VREB | Q99683 | 669 | 940 | 1374.0 | RFG:1001 | Type1 | Inactive | DFGin | 6.4905 | 14.0124 | BLAminus | -129.48, 175.2 | 61.52, 95.42 | -105.05, 19.46 | 294.04, 89.61 | -65.54, -30.46 | in-in | in | 8.7491 | Saltbr-in | 2.5759 | HRD-in | -76.83, -46.56 | 70.39, 7.92 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.122 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoi | APE10-dihe-na | 999.0, 135.01 | APE9-dihe-na | -90.36, -169.74 | APE8-dihe-in | -80.73, 139.41 | APE8-rot-out | 88.48 | APE67-dihe-in | -72.31, -15.25 | -63.35, -40.1 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.5562 | APE9-dist-in | 3.7094 | None | None | None | XRAY | 2.29 | 0.19 | 0.24 | B | 291.0 | 260.0 | 12 | 28 | 20 | 8 | [[678, 938]] | 1.0 | 6vre | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.7 | 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 | 6VREA | Q99683 | 671 | 940 | 1374.0 | RFG:1002 | Type1 | Inactive | DFGin | 6.8152 | 13.6113 | BLAminus | -129.9, 174.85 | 60.66, 96.18 | -107.07, 14.48 | 299.67, 100.35 | -66.93, -27.63 | in-in | in | 8.337 | Saltbr-in | 2.6983 | HRD-in | -75.62, -47.02 | 73.48, 5.8 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0816 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -116.85, 140.4 | APE9-dihe-na | -80.98, -165.5 | APE8-dihe-in | -71.42, 135.62 | APE8-rot-in | 312.64 | APE67-dihe-in | -74.41, -14.28 | -63.87, -41.58 | APE12-dist-in | 10.791 | APE11-dist-out | 5.4295 | APE10-dist-out | 9.8756 | APE9-dist-in | 3.6996 | None | None | None | XRAY | 2.29 | 0.19 | 0.24 | A | 291.0 | 261.0 | 9 | 28 | 21 | 7 | [[678, 938]] | 1.0 | 6vre | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.7 | 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 | 6VREB | Q99683 | 669 | 940 | 1374.0 | RFG:1001 | Type1 | Inactive | DFGin | 6.4905 | 14.0124 | BLAminus | -129.48, 175.2 | 61.52, 95.42 | -105.05, 19.46 | 294.04, 89.61 | -65.54, -30.46 | in-in | in | 8.7491 | Saltbr-in | 2.5759 | HRD-in | -76.83, -46.56 | 70.39, 7.92 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.122 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoi | APE10-dihe-na | 999.0, 135.01 | APE9-dihe-na | -90.36, -169.74 | APE8-dihe-in | -80.73, 139.41 | APE8-rot-out | 88.48 | APE67-dihe-in | -72.31, -15.25 | -63.35, -40.1 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.5562 | APE9-dist-in | 3.7094 | None | None | None | XRAY | 2.29 | 0.19 | 0.24 | B | 291.0 | 260.0 | 12 | 28 | 20 | 8 | [[678, 938]] | 1.0 | 6vre | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.7 | 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 |
|---|